2-[methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]pyridine-3-carboxylic acid

Systemtic Name: 2-[methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]pyridine-3-carboxylic acid Openeye Name: 2-[methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]pyridine-3-carboxylic acid CAS Name: 2-[methyl-(2,4,6-trimethylphenyl)sulfonylamino]-3-pyridinecarboxylic acid IUPAC Name: 2-[methyl-(2,4,6-trimethylphenyl)sulfonylamino]pyridine-3-carboxylic acid Traditional Name: 2-[mesitylsulfonyl(methyl)amino]nicotinic acid Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C)C2=C(C=CC=N2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C)C2=C(C=CC=N2)C(=O)O)C

InChI

InChI=1S/C16H18N2O4S/c1-10-8-11(2)14(12(3)9-10)23(21,22)18(4)15-13(16(19)20)6-5-7-17-15/h5-9H,1-4H3,(H,19,20)