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

Systemtic Name: tert-butyl 4-[2-(3-methylphenyl)-4-(4-methylpiperidin-1-yl)carbonyl-pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(4-methylpiperidine-1-carbonyl)-2-(m-tolyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-(3-methylphenyl)-4-[(4-methyl-1-piperidinyl)-oxomethyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(3-methylphenyl)-4-(4-methylpiperidine-1-carbonyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(4-methylpiperidine-1-carbonyl)-2-(m-tolyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H38N4O3 MolecularWeight: 466.61562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C)C4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C)C4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H38N4O3/c1-19-9-13-29(14-10-19)25(32)23-18-28-31(22-8-6-7-20(2)17-22)24(23)21-11-15-30(16-12-21)26(33)34-27(3,4)5/h6-8,17-19,21H,9-16H2,1-5H3