methyl 4-[[6-methoxy-4-[(4-methoxyphenyl)methyl]-3-oxidanylidene-1,4-diazepan-1-yl]carbonyl]benzoate

Systemtic Name: methyl 4-[[6-methoxy-4-[(4-methoxyphenyl)methyl]-3-oxidanylidene-1,4-diazepan-1-yl]carbonyl]benzoate Openeye Name: methyl 4-[6-methoxy-4-[(4-methoxyphenyl)methyl]-3-oxo-1,4-diazepane-1-carbonyl]benzoate CAS Name: 4-[[6-methoxy-4-[(4-methoxyphenyl)methyl]-3-oxo-1,4-diazepan-1-yl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[6-methoxy-4-[(4-methoxyphenyl)methyl]-3-oxo-1,4-diazepane-1-carbonyl]benzoate Traditional Name: 4-(3-keto-6-methoxy-4-p-anisyl-1,4-diazepane-1-carbonyl)benzoic acid methyl ester Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CC(=O)N(C1)CC2=CC=C(C=C2)OC)C(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1CN(CC(=O)N(C1)CC2=CC=C(C=C2)OC)C(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H26N2O6/c1-29-19-10-4-16(5-11-19)12-24-13-20(30-2)14-25(15-21(24)26)22(27)17-6-8-18(9-7-17)23(28)31-3/h4-11,20H,12-15H2,1-3H3