3-[8-methoxy-7-(2-methoxyphenyl)-2-oxidanylidene-1-(phenylmethyl)-3H-1,4-benzodiazepin-5-yl]benzamide

Systemtic Name: 3-[8-methoxy-7-(2-methoxyphenyl)-2-oxidanylidene-1-(phenylmethyl)-3H-1,4-benzodiazepin-5-yl]benzamide Openeye Name: 3-[1-benzyl-8-methoxy-7-(2-methoxyphenyl)-2-oxo-3H-1,4-benzodiazepin-5-yl]benzamide CAS Name: 3-[8-methoxy-7-(2-methoxyphenyl)-2-oxo-1-(phenylmethyl)-3H-1,4-benzodiazepin-5-yl]benzamide IUPAC Name: 3-[1-benzyl-8-methoxy-7-(2-methoxyphenyl)-2-oxo-3H-1,4-benzodiazepin-5-yl]benzamide Traditional Name: 3-[1-benzyl-2-keto-8-methoxy-7-(2-methoxyphenyl)-3H-1,4-benzodiazepin-5-yl]benzamide Formula: C31H27N3O4 MolecularWeight: 505.56378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC3=C(C=C2OC)N(C(=O)CN=C3C4=CC(=CC=C4)C(=O)N)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C2=CC3=C(C=C2OC)N(C(=O)CN=C3C4=CC(=CC=C4)C(=O)N)CC5=CC=CC=C5

InChI

InChI=1S/C31H27N3O4/c1-37-27-14-7-6-13-23(27)24-16-25-26(17-28(24)38-2)34(19-20-9-4-3-5-10-20)29(35)18-33-30(25)21-11-8-12-22(15-21)31(32)36/h3-17H,18-19H2,1-2H3,(H2,32,36)