4-methyl-3-piperidin-1-ylsulfonyl-benzoic acid

Systemtic Name: 4-methyl-3-piperidin-1-ylsulfonyl-benzoic acid Openeye Name: 4-methyl-3-(1-piperidylsulfonyl)benzoic acid CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid IUPAC Name: 4-methyl-3-piperidin-1-ylsulfonylbenzoic acid Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C13H17NO4S/c1-10-5-6-11(13(15)16)9-12(10)19(17,18)14-7-3-2-4-8-14/h5-6,9H,2-4,7-8H2,1H3,(H,15,16)