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

Systemtic Name: tert-butyl 4-[2-(4-methoxyphenyl)-4-[(phenylmethyl)carbamoyl]pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(benzylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-(4-methoxyphenyl)-4-[oxo-[(phenylmethyl)amino]methyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(benzylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(benzylcarbamoyl)-2-(4-methoxyphenyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H34N4O4 MolecularWeight: 490.59396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=C(C=C3)OC)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=C(C=C3)OC)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C28H34N4O4/c1-28(2,3)36-27(34)31-16-14-21(15-17-31)25-24(26(33)29-18-20-8-6-5-7-9-20)19-30-32(25)22-10-12-23(35-4)13-11-22/h5-13,19,21H,14-18H2,1-4H3,(H,29,33)