butyl 4-[1-(3-methylphenyl)pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: butyl 4-[1-(3-methylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: butyl 4-[1-(m-tolyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[1-(3-methylphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid butyl ester IUPAC Name: butyl 4-[1-(3-methylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[1-(m-tolyl)pyrazol-3-yl]piperidine-1-carboxylic acid butyl ester Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1CCC(CC1)C2=NN(C=C2)C3=CC=CC(=C3)C

Isomeric SMILES

CCCCOC(=O)N1CCC(CC1)C2=NN(C=C2)C3=CC=CC(=C3)C

InChI

InChI=1S/C20H27N3O2/c1-3-4-14-25-20(24)22-11-8-17(9-12-22)19-10-13-23(21-19)18-7-5-6-16(2)15-18/h5-7,10,13,15,17H,3-4,8-9,11-12,14H2,1-2H3