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

Systemtic Name: [1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-cyclohexylpropanoate Openeye Name: [1-methyl-2-(3-nitroanilino)-2-oxo-ethyl] 3-cyclohexylpropanoate CAS Name: 3-cyclohexylpropanoic acid [1-(3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-nitroanilino)-1-oxopropan-2-yl] 3-cyclohexylpropanoate Traditional Name: 3-cyclohexylpropionic acid [2-keto-1-methyl-2-(3-nitroanilino)ethyl] ester Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CCC2CCCCC2

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CCC2CCCCC2

InChI

InChI=1S/C18H24N2O5/c1-13(25-17(21)11-10-14-6-3-2-4-7-14)18(22)19-15-8-5-9-16(12-15)20(23)24/h5,8-9,12-14H,2-4,6-7,10-11H2,1H3,(H,19,22)