2-(4-methoxyphenyl)sulfonyl-1-methyl-piperidine-4-carboxylic acid

Systemtic Name: 2-(4-methoxyphenyl)sulfonyl-1-methyl-piperidine-4-carboxylic acid Openeye Name: 2-(4-methoxyphenyl)sulfonyl-1-methyl-piperidine-4-carboxylic acid CAS Name: 2-(4-methoxyphenyl)sulfonyl-1-methyl-4-piperidinecarboxylic acid IUPAC Name: 2-(4-methoxyphenyl)sulfonyl-1-methylpiperidine-4-carboxylic acid Traditional Name: 2-(4-methoxyphenyl)sulfonyl-1-methyl-isonipecotic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CN1CCC(CC1S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C14H19NO5S/c1-15-8-7-10(14(16)17)9-13(15)21(18,19)12-5-3-11(20-2)4-6-12/h3-6,10,13H,7-9H2,1-2H3,(H,16,17)