[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 4-(cyclohexylamino)-4-oxidanylidene-butanoate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 4-(cyclohexylamino)-4-oxidanylidene-butanoate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] 4-(cyclohexylamino)-4-oxo-butanoate CAS Name: 4-(cyclohexylamino)-4-oxobutanoic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] 4-(cyclohexylamino)-4-oxobutanoate Traditional Name: 4-(cyclohexylamino)-4-keto-butyric acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O6/c21-16(13-6-8-15(9-7-13)20(24)25)12-26-18(23)11-10-17(22)19-14-4-2-1-3-5-14/h6-9,14H,1-5,10-12H2,(H,19,22)