4-methyl-2-oxidanyl-5-(4-oxidanylpiperidin-1-yl)sulfonyl-benzoic acid

Systemtic Name: 4-methyl-2-oxidanyl-5-(4-oxidanylpiperidin-1-yl)sulfonyl-benzoic acid Openeye Name: 2-hydroxy-5-[(4-hydroxy-1-piperidyl)sulfonyl]-4-methyl-benzoic acid CAS Name: 2-hydroxy-5-[(4-hydroxy-1-piperidinyl)sulfonyl]-4-methylbenzoic acid IUPAC Name: 2-hydroxy-5-(4-hydroxypiperidin-1-yl)sulfonyl-4-methylbenzoic acid Traditional Name: 2-hydroxy-5-(4-hydroxypiperidino)sulfonyl-4-methyl-benzoic acid Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)O)C(=O)O)S(=O)(=O)N2CCC(CC2)O

Isomeric SMILES

CC1=C(C=C(C(=C1)O)C(=O)O)S(=O)(=O)N2CCC(CC2)O

InChI

InChI=1S/C13H17NO6S/c1-8-6-11(16)10(13(17)18)7-12(8)21(19,20)14-4-2-9(15)3-5-14/h6-7,9,15-16H,2-5H2,1H3,(H,17,18)