4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoic acid

Systemtic Name: 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoic acid Openeye Name: 4-methoxy-3-[(2-methyl-1-piperidyl)sulfonyl]benzoic acid CAS Name: 4-methoxy-3-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid IUPAC Name: 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonylbenzoic acid Traditional Name: 4-methoxy-3-(2-methylpiperidino)sulfonyl-benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC

InChI

InChI=1S/C14H19NO5S/c1-10-5-3-4-8-15(10)21(18,19)13-9-11(14(16)17)6-7-12(13)20-2/h6-7,9-10H,3-5,8H2,1-2H3,(H,16,17)