3-(7,8-dimethoxy-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl)-N-(3-phenylpropyl)benzamide

Systemtic Name: 3-(7,8-dimethoxy-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl)-N-(3-phenylpropyl)benzamide Openeye Name: 3-(7,8-dimethoxy-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)-N-(3-phenylpropyl)benzamide CAS Name: 3-(7,8-dimethoxy-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)-N-(3-phenylpropyl)benzamide IUPAC Name: 3-(7,8-dimethoxy-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)-N-(3-phenylpropyl)benzamide Traditional Name: 3-(2-keto-7,8-dimethoxy-1-methyl-3H-1,4-benzodiazepin-5-yl)-N-(3-phenylpropyl)benzamide Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN=C(C2=CC(=C(C=C21)OC)OC)C3=CC(=CC=C3)C(=O)NCCCC4=CC=CC=C4

Isomeric SMILES

CN1C(=O)CN=C(C2=CC(=C(C=C21)OC)OC)C3=CC(=CC=C3)C(=O)NCCCC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O4/c1-31-23-17-25(35-3)24(34-2)16-22(23)27(30-18-26(31)32)20-12-7-13-21(15-20)28(33)29-14-8-11-19-9-5-4-6-10-19/h4-7,9-10,12-13,15-17H,8,11,14,18H2,1-3H3,(H,29,33)