tert-butyl 4-[2-(2-chlorophenyl)-4-piperidin-1-ylcarbonyl-pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(2-chlorophenyl)-4-piperidin-1-ylcarbonyl-pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(2-chlorophenyl)-4-(piperidine-1-carbonyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-(2-chlorophenyl)-4-[oxo(1-piperidinyl)methyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(2-chlorophenyl)-4-(piperidine-1-carbonyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[2-(2-chlorophenyl)-4-(piperidine-1-carbonyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H33ClN4O3 MolecularWeight: 473.00752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=CC=C3Cl)C(=O)N4CCCCC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=CC=C3Cl)C(=O)N4CCCCC4

InChI

InChI=1S/C25H33ClN4O3/c1-25(2,3)33-24(32)29-15-11-18(12-16-29)22-19(23(31)28-13-7-4-8-14-28)17-27-30(22)21-10-6-5-9-20(21)26/h5-6,9-10,17-18H,4,7-8,11-16H2,1-3H3