N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)ethanamide

Systemtic Name: N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)ethanamide Openeye Name: N-(3,5-dimethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)acetamide CAS Name: N-(3,5-dimethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-2-(4-nitrophenyl)acetamide IUPAC Name: N-(3,5-dimethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)acetamide Traditional Name: N-(6-keto-3,5-dimethyl-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)acetamide Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)CC4=CC=C(C=C4)[N+](=O)[O-])C(=O)N2C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)CC4=CC=C(C=C4)[N+](=O)[O-])C(=O)N2C

InChI

InChI=1S/C23H19N3O5/c1-14-3-9-21-19(11-14)25(2)23(28)18-13-16(6-10-20(18)31-21)24-22(27)12-15-4-7-17(8-5-15)26(29)30/h3-11,13H,12H2,1-2H3,(H,24,27)