4-(2-chloranyl-6-methyl-pyridin-3-yl)sulfonylbenzoic acid

Systemtic Name: 4-(2-chloranyl-6-methyl-pyridin-3-yl)sulfonylbenzoic acid Openeye Name: 4-[(2-chloro-6-methyl-3-pyridyl)sulfonyl]benzoic acid CAS Name: 4-[(2-chloro-6-methyl-3-pyridinyl)sulfonyl]benzoic acid IUPAC Name: 4-(2-chloro-6-methylpyridin-3-yl)sulfonylbenzoic acid Traditional Name: 4-[(2-chloro-6-methyl-3-pyridyl)sulfonyl]benzoic acid Formula: C13H10ClNO4S MolecularWeight: 311.7408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O)Cl

Isomeric SMILES

CC1=NC(=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O)Cl

InChI

InChI=1S/C13H10ClNO4S/c1-8-2-7-11(12(14)15-8)20(18,19)10-5-3-9(4-6-10)13(16)17/h2-7H,1H3,(H,16,17)