methyl 1-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylate Openeye Name: methyl 1-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylate CAS Name: 1-[(3-tert-butyl-1-cyclopentyl-4-pyrazolyl)sulfonyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-tert-butyl-1-cyclopentylpyrazol-4-yl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonylisonipecotic acid methyl ester Formula: C19H31N3O4S MolecularWeight: 397.53214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCC(CC2)C(=O)OC)C3CCCC3

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCC(CC2)C(=O)OC)C3CCCC3

InChI

InChI=1S/C19H31N3O4S/c1-19(2,3)17-16(13-22(20-17)15-7-5-6-8-15)27(24,25)21-11-9-14(10-12-21)18(23)26-4/h13-15H,5-12H2,1-4H3