methyl 2-[4-(4-methoxyphenyl)-2-oxidanylidene-1-(phenylmethyl)-3,5-dihydro-1,4-benzodiazepin-3-yl]ethanoate

Systemtic Name: methyl 2-[4-(4-methoxyphenyl)-2-oxidanylidene-1-(phenylmethyl)-3,5-dihydro-1,4-benzodiazepin-3-yl]ethanoate Openeye Name: methyl 2-[1-benzyl-4-(4-methoxyphenyl)-2-oxo-3,5-dihydro-1,4-benzodiazepin-3-yl]acetate CAS Name: 2-[4-(4-methoxyphenyl)-2-oxo-1-(phenylmethyl)-3,5-dihydro-1,4-benzodiazepin-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[1-benzyl-4-(4-methoxyphenyl)-2-oxo-3,5-dihydro-1,4-benzodiazepin-3-yl]acetate Traditional Name: 2-[1-benzyl-2-keto-4-(4-methoxyphenyl)-3,5-dihydro-1,4-benzodiazepin-3-yl]acetic acid methyl ester Formula: C26H26N2O4 MolecularWeight: 430.49564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC3=CC=CC=C3N(C(=O)C2CC(=O)OC)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2CC3=CC=CC=C3N(C(=O)C2CC(=O)OC)CC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O4/c1-31-22-14-12-21(13-15-22)27-18-20-10-6-7-11-23(20)28(17-19-8-4-3-5-9-19)26(30)24(27)16-25(29)32-2/h3-15,24H,16-18H2,1-2H3