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

Systemtic Name: 1-(4-aminocarbonylphenyl)sulfonylpiperidine-3-carboxylic acid Openeye Name: 1-(4-carbamoylphenyl)sulfonylpiperidine-3-carboxylic acid CAS Name: 1-(4-carbamoylphenyl)sulfonyl-3-piperidinecarboxylic acid IUPAC Name: 1-(4-carbamoylphenyl)sulfonylpiperidine-3-carboxylic acid Traditional Name: 1-(4-carbamoylphenyl)sulfonylnipecotic acid Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N)C(=O)O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N)C(=O)O

InChI

InChI=1S/C13H16N2O5S/c14-12(16)9-3-5-11(6-4-9)21(19,20)15-7-1-2-10(8-15)13(17)18/h3-6,10H,1-2,7-8H2,(H2,14,16)(H,17,18)