[4-(1,5-diphenylpentan-3-yl)-3-oxidanylidene-1,4-diazepan-1-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [4-(1,5-diphenylpentan-3-yl)-3-oxidanylidene-1,4-diazepan-1-yl] 3,4,5-trimethoxybenzoate Openeye Name: [3-oxo-4-(1-phenethyl-3-phenyl-propyl)-1,4-diazepan-1-yl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [4-(1,5-diphenylpentan-3-yl)-3-oxo-1,4-diazepan-1-yl] ester IUPAC Name: [4-(1,5-diphenylpentan-3-yl)-3-oxo-1,4-diazepan-1-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [3-keto-4-(1-phenethyl-3-phenyl-propyl)-1,4-diazepan-1-yl] ester Formula: C32H38N2O6 MolecularWeight: 546.65392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)ON2CCCN(C(=O)C2)C(CCC3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)ON2CCCN(C(=O)C2)C(CCC3=CC=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C32H38N2O6/c1-37-28-21-26(22-29(38-2)31(28)39-3)32(36)40-33-19-10-20-34(30(35)23-33)27(17-15-24-11-6-4-7-12-24)18-16-25-13-8-5-9-14-25/h4-9,11-14,21-22,27H,10,15-20,23H2,1-3H3