7-[[3-[2-[3-[6-[5-[3-[2-[3-[[(4,6-dimethyl-2-oxidanylidene-chromen-7-yl)-ethyl-amino]methyl]-5-[2-tri(propan-2-yl)silylethynyl]phenyl]ethynyl]-5-(hexoxymethyl)phenyl]pyridin-2-yl]pyridin-3-yl]-5-(hexoxymethyl)phenyl]ethynyl]-5-[2-tri(propan-2-yl)silylethynyl]phenyl]methyl-ethyl-amino]-4,6-dimethyl-chromen-2-one

Systemtic Name: 7-[[3-[2-[3-[6-[5-[3-[2-[3-[[(4,6-dimethyl-2-oxidanylidene-chromen-7-yl)-ethyl-amino]methyl]-5-[2-tri(propan-2-yl)silylethynyl]phenyl]ethynyl]-5-(hexoxymethyl)phenyl]pyridin-2-yl]pyridin-3-yl]-5-(hexoxymethyl)phenyl]ethynyl]-5-[2-tri(propan-2-yl)silylethynyl]phenyl]methyl-ethyl-amino]-4,6-dimethyl-chromen-2-one Openeye Name: 7-[[3-[2-[3-[6-[5-[3-[2-[3-[[(4,6-dimethyl-2-oxo-chromen-7-yl)-ethyl-amino]methyl]-5-(2-triisopropylsilylethynyl)phenyl]ethynyl]-5-(hexoxymethyl)phenyl]-2-pyridyl]-3-pyridyl]-5-(hexoxymethyl)phenyl]ethynyl]-5-(2-triisopropylsilylethynyl)phenyl]methyl-ethyl-amino]-4,6-dimethyl-chromen-2-one CAS Name: 7-[[3-[2-[3-[6-[5-[3-[2-[3-[[(4,6-dimethyl-2-oxo-1-benzopyran-7-yl)-ethylamino]methyl]-5-[2-tri(propan-2-yl)silylethynyl]phenyl]ethynyl]-5-(hexoxymethyl)phenyl]-2-pyridinyl]-3-pyridinyl]-5-(hexoxymethyl)phenyl]ethynyl]-5-[2-tri(propan-2-yl)silylethynyl]phenyl]methyl-ethylamino]-4,6-dimethyl-1-benzopyran-2-one IUPAC Name: 7-[[3-[2-[3-[6-[5-[3-[2-[3-[[(4,6-dimethyl-2-oxochromen-7-yl)-ethylamino]methyl]-5-[2-tri(propan-2-yl)silylethynyl]phenyl]ethynyl]-5-(hexoxymethyl)phenyl]pyridin-2-yl]pyridin-3-yl]-5-(hexoxymethyl)phenyl]ethynyl]-5-[2-tri(propan-2-yl)silylethynyl]phenyl]methyl-ethylamino]-4,6-dimethylchromen-2-one Traditional Name: 7-[ethyl-[3-[2-[3-[6-[5-[3-[2-[3-[[ethyl-(2-keto-4,6-dimethyl-chromen-7-yl)amino]methyl]-5-(2-triisopropylsilylethynyl)phenyl]ethynyl]-5-(hexoxymethyl)phenyl]-2-pyridyl]-3-pyridyl]-5-(hexoxymethyl)phenyl]ethynyl]-5-(2-triisopropylsilylethynyl)benzyl]amino]-4,6-dimethyl-coumarin Formula: C102H122N4O6Si2 MolecularWeight: 1556.25428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCC1=CC(=CC(=C1)C2=CN=C(C=C2)C3=NC=C(C=C3)C4=CC(=CC(=C4)C#CC5=CC(=CC(=C5)CN(CC)C6=C(C=C7C(=CC(=O)OC7=C6)C)C)C#C[Si](C(C)C)(C(C)C)C(C)C)COCCCCCC)C#CC8=CC(=CC(=C8)CN(CC)C9=C(C=C1C(=CC(=O)OC1=C9)C)C)C#C[Si](C(C)C)(C(C)C)C(C)C

Isomeric SMILES

CCCCCCOCC1=CC(=CC(=C1)C2=CN=C(C=C2)C3=NC=C(C=C3)C4=CC(=CC(=C4)C#CC5=CC(=CC(=C5)CN(CC)C6=C(C=C7C(=CC(=O)OC7=C6)C)C)C#C[Si](C(C)C)(C(C)C)C(C)C)COCCCCCC)C#CC8=CC(=CC(=C8)CN(CC)C9=C(C=C1C(=CC(=O)OC1=C9)C)C)C#C[Si](C(C)C)(C(C)C)C(C)C

InChI

InChI=1S/C102H122N4O6Si2/c1-21-25-27-29-41-109-67-87-55-81(33-31-79-49-83(39-43-113(69(5)6,70(7)8)71(9)10)53-85(51-79)65-105(23-3)97-61-99-93(45-77(97)19)75(17)47-101(107)111-99)57-91(59-87)89-35-37-95(103-63-89)96-38-36-90(64-104-96)92-58-82(56-88(60-92)68-110-42-30-28-26-22-2)34-32-80-50-84(40-44-114(72(11)12,73(13)14)74(15)16)54-86(52-80)66-106(24-4)98-62-100-94(46-78(98)20)76(18)48-102(108)112-100/h35-38,45-64,69-74H,21-30,41-42,65-68H2,1-20H3