tert-butyl 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylcarbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylcarbamoyl]piperidine-1-carboxylate CAS Name: 4-[[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylcarbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H32N4O3/c1-16-20(17(2)27(25-16)19-9-7-6-8-10-19)15-24-21(28)18-11-13-26(14-12-18)22(29)30-23(3,4)5/h6-10,18H,11-15H2,1-5H3,(H,24,28)