2-azanyl-4-[3-methoxy-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-methoxy-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[3-methoxy-4-(2-oxo-2-pyrrolidin-1-yl-ethoxy)phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[3-methoxy-4-[2-oxo-2-(1-pyrrolidinyl)ethoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3-methoxy-4-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-5-keto-4-[4-(2-keto-2-pyrrolidino-ethoxy)-3-methoxy-phenyl]-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC(=O)N4CCCC4)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC(=O)N4CCCC4)OC)C(=O)C1)C

InChI

InChI=1S/C25H29N3O5/c1-25(2)11-17(29)23-20(12-25)33-24(27)16(13-26)22(23)15-6-7-18(19(10-15)31-3)32-14-21(30)28-8-4-5-9-28/h6-7,10,22H,4-5,8-9,11-12,14,27H2,1-3H3