ethyl 1-[2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazol-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[2-(3-chlorophenyl)-5-(4-nitrophenyl)-3-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[2-(3-chlorophenyl)-5-(4-nitrophenyl)pyrazole-3-carbonyl]nipecotic acid ethyl ester Formula: C24H23ClN4O5 MolecularWeight: 482.91622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H23ClN4O5/c1-2-34-24(31)17-5-4-12-27(15-17)23(30)22-14-21(16-8-10-19(11-9-16)29(32)33)26-28(22)20-7-3-6-18(25)13-20/h3,6-11,13-14,17H,2,4-5,12,15H2,1H3