3-methyl-4-nitro-N-(5-oxidanylidene-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzamide

Systemtic Name: 3-methyl-4-nitro-N-(5-oxidanylidene-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzamide Openeye Name: 3-methyl-4-nitro-N-(5-oxo-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzamide CAS Name: 3-methyl-4-nitro-N-(5-oxo-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzamide IUPAC Name: 3-methyl-4-nitro-N-(5-oxo-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzamide Traditional Name: N-(5-keto-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)-3-methyl-4-nitro-benzamide Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCCN(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCCN(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O5/c1-15-13-16(7-9-20(15)26(29)30)22(27)24-17-8-10-21-19(14-17)23(28)25(11-12-31-21)18-5-3-2-4-6-18/h2-10,13-14H,11-12H2,1H3,(H,24,27)