1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylic acid CAS Name: 1-(3-acetylphenyl)sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-(3-acetylphenyl)sulfonylisonipecotic acid Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO5S/c1-10(16)12-3-2-4-13(9-12)21(19,20)15-7-5-11(6-8-15)14(17)18/h2-4,9,11H,5-8H2,1H3,(H,17,18)