[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-cyclohexylbutanoate

Systemtic Name: [1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-cyclohexylbutanoate Openeye Name: [1-methyl-2-(3-nitroanilino)-2-oxo-ethyl] 4-cyclohexylbutanoate CAS Name: 4-cyclohexylbutanoic acid [1-(3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-nitroanilino)-1-oxopropan-2-yl] 4-cyclohexylbutanoate Traditional Name: 4-cyclohexylbutyric acid [2-keto-1-methyl-2-(3-nitroanilino)ethyl] ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CCCC2CCCCC2

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CCCC2CCCCC2

InChI

InChI=1S/C19H26N2O5/c1-14(19(23)20-16-10-6-11-17(13-16)21(24)25)26-18(22)12-5-9-15-7-3-2-4-8-15/h6,10-11,13-15H,2-5,7-9,12H2,1H3,(H,20,23)