ethyl 1-(4-pyrazol-1-ylphenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-(4-pyrazol-1-ylphenyl)sulfonylpiperidine-3-carboxylate Openeye Name: ethyl 1-(4-pyrazol-1-ylphenyl)sulfonylpiperidine-3-carboxylate CAS Name: 1-[4-(1-pyrazolyl)phenyl]sulfonyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-pyrazol-1-ylphenyl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-(4-pyrazol-1-ylphenyl)sulfonylnipecotic acid ethyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C17H21N3O4S/c1-2-24-17(21)14-5-3-11-19(13-14)25(22,23)16-8-6-15(7-9-16)20-12-4-10-18-20/h4,6-10,12,14H,2-3,5,11,13H2,1H3