tert-butyl 4-[4-[(2-ethylphenyl)carbamoyl]-2-phenyl-pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(2-ethylphenyl)carbamoyl]-2-phenyl-pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(2-ethylphenyl)carbamoyl]-2-phenyl-pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-ethylanilino)-oxomethyl]-2-phenyl-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(2-ethylphenyl)carbamoyl]-2-phenylpyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-ethylphenyl)carbamoyl]-2-phenyl-pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H34N4O3 MolecularWeight: 474.59456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)C4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)C4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H34N4O3/c1-5-20-11-9-10-14-24(20)30-26(33)23-19-29-32(22-12-7-6-8-13-22)25(23)21-15-17-31(18-16-21)27(34)35-28(2,3)4/h6-14,19,21H,5,15-18H2,1-4H3,(H,30,33)