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

Systemtic Name: tert-butyl 4-[2-phenyl-4-(4-phenylpiperazin-1-yl)carbonyl-pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-phenyl-4-(4-phenylpiperazine-1-carbonyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[oxo-(4-phenyl-1-piperazinyl)methyl]-2-phenyl-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-phenyl-4-(4-phenylpiperazine-1-carbonyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[2-phenyl-4-(4-phenylpiperazine-1-carbonyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H37N5O3 MolecularWeight: 515.64648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H37N5O3/c1-30(2,3)38-29(37)34-16-14-23(15-17-34)27-26(22-31-35(27)25-12-8-5-9-13-25)28(36)33-20-18-32(19-21-33)24-10-6-4-7-11-24/h4-13,22-23H,14-21H2,1-3H3