ethyl 1-[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(4-methyl-3-nitro-anilino)-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: 1-[2-(4-methyl-3-nitroanilino)-2-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-methyl-3-nitroanilino)-2-oxoethyl]piperidine-3-carboxylate Traditional Name: 1-[2-keto-2-(4-methyl-3-nitro-anilino)ethyl]nipecotic acid ethyl ester Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC(=O)NC2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O5/c1-3-25-17(22)13-5-4-8-19(10-13)11-16(21)18-14-7-6-12(2)15(9-14)20(23)24/h6-7,9,13H,3-5,8,10-11H2,1-2H3,(H,18,21)