1-(4-ethylphenyl)sulfonyl-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-(4-ethylphenyl)sulfonyl-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-(4-ethylphenyl)sulfonyl-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-(4-ethylphenyl)sulfonyl-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-(4-ethylphenyl)sulfonyl-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-(4-ethylphenyl)sulfonyl-4-phenyl-isonipecotic acid Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H23NO4S/c1-2-16-8-10-18(11-9-16)26(24,25)21-14-12-20(13-15-21,19(22)23)17-6-4-3-5-7-17/h3-11H,2,12-15H2,1H3,(H,22,23)