methyl 1-[(3,4,5-trimethoxy-2-nitro-phenyl)carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[(3,4,5-trimethoxy-2-nitro-phenyl)carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[(3,4,5-trimethoxy-2-nitro-benzoyl)amino]cyclohexanecarboxylate CAS Name: 1-[[oxo-(3,4,5-trimethoxy-2-nitrophenyl)methyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(3,4,5-trimethoxy-2-nitrobenzoyl)amino]cyclohexane-1-carboxylate Traditional Name: 1-[(3,4,5-trimethoxy-2-nitro-benzoyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C18H24N2O8 MolecularWeight: 396.39176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2(CCCCC2)C(=O)OC)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2(CCCCC2)C(=O)OC)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H24N2O8/c1-25-12-10-11(13(20(23)24)15(27-3)14(12)26-2)16(21)19-18(17(22)28-4)8-6-5-7-9-18/h10H,5-9H2,1-4H3,(H,19,21)