bis(2-methylpropyl) 2-[[4-[[4,6-bis[[4-[3-(2-methylpropoxy)-2-(2-methylpropoxycarbonyl)-3-oxidanylidene-prop-1-enyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]phenyl]methylidene]propanedioate

Systemtic Name: bis(2-methylpropyl) 2-[[4-[[4,6-bis[[4-[3-(2-methylpropoxy)-2-(2-methylpropoxycarbonyl)-3-oxidanylidene-prop-1-enyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]phenyl]methylidene]propanedioate Openeye Name: diisobutyl 2-[[4-[[4,6-bis[4-(3-isobutoxy-2-isobutoxycarbonyl-3-oxo-prop-1-enyl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]methylene]propanedioate CAS Name: 2-[[4-[[4,6-bis[4-[3-(2-methylpropoxy)-2-[2-methylpropoxy(oxo)methyl]-3-oxoprop-1-enyl]anilino]-1,3,5-triazin-2-yl]amino]phenyl]methylidene]propanedioic acid bis(2-methylpropyl) ester IUPAC Name: bis(2-methylpropyl) 2-[[4-[[4,6-bis[4-[3-(2-methylpropoxy)-2-(2-methylpropoxycarbonyl)-3-oxoprop-1-enyl]anilino]-1,3,5-triazin-2-yl]amino]phenyl]methylidene]propanedioate Traditional Name: 2-[4-[[4,6-bis[4-(3-isobutoxy-2-isobutoxycarbonyl-3-keto-prop-1-enyl)anilino]-s-triazin-2-yl]amino]benzylidene]malonic acid diisobutyl ester Formula: C57H72N6O12 MolecularWeight: 1033.21458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(=CC1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)C=C(C(=O)OCC(C)C)C(=O)OCC(C)C)NC4=CC=C(C=C4)C=C(C(=O)OCC(C)C)C(=O)OCC(C)C)C(=O)OCC(C)C

Isomeric SMILES

CC(C)COC(=O)C(=CC1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)C=C(C(=O)OCC(C)C)C(=O)OCC(C)C)NC4=CC=C(C=C4)C=C(C(=O)OCC(C)C)C(=O)OCC(C)C)C(=O)OCC(C)C

InChI

InChI=1S/C57H72N6O12/c1-34(2)28-70-49(64)46(50(65)71-29-35(3)4)25-40-13-19-43(20-14-40)58-55-61-56(59-44-21-15-41(16-22-44)26-47(51(66)72-30-36(5)6)52(67)73-31-37(7)8)63-57(62-55)60-45-23-17-42(18-24-45)27-48(53(68)74-32-38(9)10)54(69)75-33-39(11)12/h13-27,34-39H,28-33H2,1-12H3,(H3,58,59,60,61,62,63)