6,9-dimethyl-N-(4-nitrophenyl)-3-oxidanylidene-4,5-dihydro-1,4-benzoxazepine-5-carboxamide

Systemtic Name: 6,9-dimethyl-N-(4-nitrophenyl)-3-oxidanylidene-4,5-dihydro-1,4-benzoxazepine-5-carboxamide Openeye Name: 6,9-dimethyl-N-(4-nitrophenyl)-3-oxo-4,5-dihydro-1,4-benzoxazepine-5-carboxamide CAS Name: 6,9-dimethyl-N-(4-nitrophenyl)-3-oxo-4,5-dihydro-1,4-benzoxazepine-5-carboxamide IUPAC Name: 6,9-dimethyl-N-(4-nitrophenyl)-3-oxo-4,5-dihydro-1,4-benzoxazepine-5-carboxamide Traditional Name: 3-keto-6,9-dimethyl-N-(4-nitrophenyl)-4,5-dihydro-1,4-benzoxazepine-5-carboxamide Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(NC(=O)COC2=C(C=C1)C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(NC(=O)COC2=C(C=C1)C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O5/c1-10-3-4-11(2)17-15(10)16(20-14(22)9-26-17)18(23)19-12-5-7-13(8-6-12)21(24)25/h3-8,16H,9H2,1-2H3,(H,19,23)(H,20,22)