methyl 1-[(4-methoxy-3-nitro-phenyl)carbonylamino]cycloheptane-1-carboxylate

Systemtic Name: methyl 1-[(4-methoxy-3-nitro-phenyl)carbonylamino]cycloheptane-1-carboxylate Openeye Name: methyl 1-[(4-methoxy-3-nitro-benzoyl)amino]cycloheptanecarboxylate CAS Name: 1-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-1-cycloheptanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-methoxy-3-nitrobenzoyl)amino]cycloheptane-1-carboxylate Traditional Name: 1-[(4-methoxy-3-nitro-benzoyl)amino]cycloheptanecarboxylic acid methyl ester Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2(CCCCCC2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2(CCCCCC2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H22N2O6/c1-24-14-8-7-12(11-13(14)19(22)23)15(20)18-17(16(21)25-2)9-5-3-4-6-10-17/h7-8,11H,3-6,9-10H2,1-2H3,(H,18,20)