ethyl 1-(3-tert-butyl-1-propan-2-yl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-tert-butyl-1-propan-2-yl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(3-tert-butyl-1-isopropyl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylate CAS Name: 1-[(3-tert-butyl-1-propan-2-yl-4-pyrazolyl)sulfonyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-tert-butyl-1-propan-2-ylpyrazol-4-yl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-tert-butyl-1-isopropyl-pyrazol-4-yl)sulfonylisonipecotic acid ethyl ester Formula: C18H31N3O4S MolecularWeight: 385.52144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CN(N=C2C(C)(C)C)C(C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CN(N=C2C(C)(C)C)C(C)C

InChI

InChI=1S/C18H31N3O4S/c1-7-25-17(22)14-8-10-20(11-9-14)26(23,24)15-12-21(13(2)3)19-16(15)18(4,5)6/h12-14H,7-11H2,1-6H3