4-(4-chlorophenyl)sulfanyl-1-oxidanidyl-pyridin-1-ium-3-carboxylic acid

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-1-oxidanidyl-pyridin-1-ium-3-carboxylic acid Openeye Name: 4-(4-chlorophenyl)sulfanyl-1-oxido-pyridin-1-ium-3-carboxylic acid CAS Name: 4-[(4-chlorophenyl)thio]-1-oxido-3-pyridin-1-iumcarboxylic acid IUPAC Name: 4-(4-chlorophenyl)sulfanyl-1-oxidopyridin-1-ium-3-carboxylic acid Traditional Name: 4-[(4-chlorophenyl)thio]-1-oxido-pyridin-1-ium-3-carboxylic acid Formula: C12H8ClNO3S MolecularWeight: 281.71482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=C(C=[N+](C=C2)[O-])C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1SC2=C(C=[N+](C=C2)[O-])C(=O)O)Cl

InChI

InChI=1S/C12H8ClNO3S/c13-8-1-3-9(4-2-8)18-11-5-6-14(17)7-10(11)12(15)16/h1-7H,(H,15,16)