tert-butyl 4-[2-(4-methoxyphenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(4-methoxyphenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-methoxyphenyl)-4-[4-(2-pyridyl)piperazine-1-carbonyl]pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-(4-methoxyphenyl)-4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-methoxyphenyl)-4-(4-pyridin-2-ylpiperazine-1-carbonyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[2-(4-methoxyphenyl)-4-[4-(2-pyridyl)piperazine-1-carbonyl]pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H38N6O4 MolecularWeight: 546.66052

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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)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=C(C=C3)OC)C(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C30H38N6O4/c1-30(2,3)40-29(38)35-15-12-22(13-16-35)27-25(21-32-36(27)23-8-10-24(39-4)11-9-23)28(37)34-19-17-33(18-20-34)26-7-5-6-14-31-26/h5-11,14,21-22H,12-13,15-20H2,1-4H3