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

Systemtic Name: [1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] cyclohexanecarboxylate Openeye Name: [1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-nitroanilino)-1-oxopropan-2-yl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)C2CCCCC2

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)C2CCCCC2

InChI

InChI=1S/C16H20N2O5/c1-11(23-16(20)12-7-3-2-4-8-12)15(19)17-13-9-5-6-10-14(13)18(21)22/h5-6,9-12H,2-4,7-8H2,1H3,(H,17,19)