5-[methyl-(4-methylphenyl)sulfonyl-amino]pyridine-3-carboxylic acid

Systemtic Name: 5-[methyl-(4-methylphenyl)sulfonyl-amino]pyridine-3-carboxylic acid Openeye Name: 5-[methyl(p-tolylsulfonyl)amino]pyridine-3-carboxylic acid CAS Name: 5-[methyl-(4-methylphenyl)sulfonylamino]-3-pyridinecarboxylic acid IUPAC Name: 5-[methyl-(4-methylphenyl)sulfonylamino]pyridine-3-carboxylic acid Traditional Name: 5-[methyl(tosyl)amino]nicotinic acid Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CN=CC(=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CN=CC(=C2)C(=O)O

InChI

InChI=1S/C14H14N2O4S/c1-10-3-5-13(6-4-10)21(19,20)16(2)12-7-11(14(17)18)8-15-9-12/h3-9H,1-2H3,(H,17,18)