(2Z)-2-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]imino-N-(2-methoxy-4-nitro-phenyl)ethanamide

Systemtic Name: (2Z)-2-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]imino-N-(2-methoxy-4-nitro-phenyl)ethanamide Openeye Name: (2Z)-2-[2-(azepan-1-yl)-2-oxo-ethoxy]imino-N-(2-methoxy-4-nitro-phenyl)acetamide CAS Name: (2Z)-2-[2-(1-azepanyl)-2-oxoethoxy]imino-N-(2-methoxy-4-nitrophenyl)acetamide IUPAC Name: (2Z)-2-[2-(azepan-1-yl)-2-oxoethoxy]imino-N-(2-methoxy-4-nitrophenyl)acetamide Traditional Name: (2Z)-2-[2-(azepan-1-yl)-2-keto-ethyl]oximino-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C17H22N4O6 MolecularWeight: 378.37978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C=NOCC(=O)N2CCCCCC2

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)/C=N\OCC(=O)N2CCCCCC2

InChI

InChI=1S/C17H22N4O6/c1-26-15-10-13(21(24)25)6-7-14(15)19-16(22)11-18-27-12-17(23)20-8-4-2-3-5-9-20/h6-7,10-11H,2-5,8-9,12H2,1H3,(H,19,22)/b18-11-