2-(1-ethyl-7,8-dimethoxy-4-oxidanylidene-3-phenyl-5a,9a-dihydro-5H-2,3-benzodiazepin-5-yl)-N-phenyl-ethanamide

Systemtic Name: 2-(1-ethyl-7,8-dimethoxy-4-oxidanylidene-3-phenyl-5a,9a-dihydro-5H-2,3-benzodiazepin-5-yl)-N-phenyl-ethanamide Openeye Name: 2-(1-ethyl-7,8-dimethoxy-4-oxo-3-phenyl-5a,9a-dihydro-5H-2,3-benzodiazepin-5-yl)-N-phenyl-acetamide CAS Name: 2-(1-ethyl-7,8-dimethoxy-4-oxo-3-phenyl-5a,9a-dihydro-5H-2,3-benzodiazepin-5-yl)-N-phenylacetamide IUPAC Name: 2-(1-ethyl-7,8-dimethoxy-4-oxo-3-phenyl-5a,9a-dihydro-5H-2,3-benzodiazepin-5-yl)-N-phenylacetamide Traditional Name: 2-(1-ethyl-4-keto-7,8-dimethoxy-3-phenyl-5a,9a-dihydro-5H-2,3-benzodiazepin-5-yl)-N-phenyl-acetamide Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)C(C2C1C=C(C(=C2)OC)OC)CC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1=NN(C(=O)C(C2C1C=C(C(=C2)OC)OC)CC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4/c1-4-23-21-16-25(34-3)24(33-2)15-20(21)22(17-26(31)28-18-11-7-5-8-12-18)27(32)30(29-23)19-13-9-6-10-14-19/h5-16,20-22H,4,17H2,1-3H3,(H,28,31)