ethyl 1-[3-[(3-nitrophenyl)amino]-3-oxidanylidene-propyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[(3-nitrophenyl)amino]-3-oxidanylidene-propyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-(3-nitroanilino)-3-oxo-propyl]piperidine-3-carboxylate CAS Name: 1-[3-(3-nitroanilino)-3-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(3-nitroanilino)-3-oxopropyl]piperidine-3-carboxylate Traditional Name: 1-[3-keto-3-(3-nitroanilino)propyl]nipecotic acid ethyl ester Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O5/c1-2-25-17(22)13-5-4-9-19(12-13)10-8-16(21)18-14-6-3-7-15(11-14)20(23)24/h3,6-7,11,13H,2,4-5,8-10,12H2,1H3,(H,18,21)