ethyl 1-[1-(4-methylphenyl)-5-propan-2-yl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(4-methylphenyl)-5-propan-2-yl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[5-isopropyl-1-(p-tolyl)pyrazole-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-(4-methylphenyl)-5-propan-2-yl-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-methylphenyl)-5-propan-2-ylpyrazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[5-isopropyl-1-(p-tolyl)pyrazole-4-carbonyl]nipecotic acid ethyl ester Formula: C22H29N3O3 MolecularWeight: 383.48396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)C)C(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)C)C(C)C

InChI

InChI=1S/C22H29N3O3/c1-5-28-22(27)17-7-6-12-24(14-17)21(26)19-13-23-25(20(19)15(2)3)18-10-8-16(4)9-11-18/h8-11,13,15,17H,5-7,12,14H2,1-4H3