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

Systemtic Name: tert-butyl 4-[2-(4-methylphenyl)-4-[(phenylmethyl)carbamoyl]pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(benzylcarbamoyl)-2-(p-tolyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-(4-methylphenyl)-4-[oxo-[(phenylmethyl)amino]methyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(benzylcarbamoyl)-2-(4-methylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(benzylcarbamoyl)-2-(p-tolyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H34N4O3 MolecularWeight: 474.59456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC=CC=C3)C4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC=CC=C3)C4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H34N4O3/c1-20-10-12-23(13-11-20)32-25(22-14-16-31(17-15-22)27(34)35-28(2,3)4)24(19-30-32)26(33)29-18-21-8-6-5-7-9-21/h5-13,19,22H,14-18H2,1-4H3,(H,29,33)