5-methoxy-2-[2-(methylcarbamoyl)phenyl]sulfanyl-benzoic acid

Systemtic Name: 5-methoxy-2-[2-(methylcarbamoyl)phenyl]sulfanyl-benzoic acid Openeye Name: 5-methoxy-2-[2-(methylcarbamoyl)phenyl]sulfanyl-benzoic acid CAS Name: 5-methoxy-2-[[2-(methylcarbamoyl)phenyl]thio]benzoic acid IUPAC Name: 5-methoxy-2-[2-(methylcarbamoyl)phenyl]sulfanylbenzoic acid Traditional Name: 5-methoxy-2-[[2-(methylcarbamoyl)phenyl]thio]benzoic acid Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1SC2=C(C=C(C=C2)OC)C(=O)O

Isomeric SMILES

CNC(=O)C1=CC=CC=C1SC2=C(C=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C16H15NO4S/c1-17-15(18)11-5-3-4-6-13(11)22-14-8-7-10(21-2)9-12(14)16(19)20/h3-9H,1-2H3,(H,17,18)(H,19,20)