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

Systemtic Name: N-(3-chloranyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)ethanamide Openeye Name: N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)acetamide CAS Name: N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)acetamide IUPAC Name: N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)acetamide Traditional Name: N-(3-chloro-6-keto-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-(4-nitrophenyl)acetamide Formula: C21H14ClN3O5 MolecularWeight: 423.80596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NC2=CC3=C(C=C2)OC4=C(C=C(C=C4)Cl)NC3=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(=O)NC2=CC3=C(C=C2)OC4=C(C=C(C=C4)Cl)NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClN3O5/c22-13-3-7-19-17(10-13)24-21(27)16-11-14(4-8-18(16)30-19)23-20(26)9-12-1-5-15(6-2-12)25(28)29/h1-8,10-11H,9H2,(H,23,26)(H,24,27)