5-chloranyl-4-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]-2-methoxy-benzoic acid

Systemtic Name: 5-chloranyl-4-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]-2-methoxy-benzoic acid Openeye Name: 5-chloro-4-[(2-chloro-5-methylsulfanyl-benzoyl)amino]-2-methoxy-benzoic acid CAS Name: 5-chloro-4-[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]amino]-2-methoxybenzoic acid IUPAC Name: 5-chloro-4-[(2-chloro-5-methylsulfanylbenzoyl)amino]-2-methoxybenzoic acid Traditional Name: 5-chloro-4-[[2-chloro-5-(methylthio)benzoyl]amino]-2-methoxy-benzoic acid Formula: C16H13Cl2NO4S MolecularWeight: 386.24972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)O)Cl)NC(=O)C2=C(C=CC(=C2)SC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)O)Cl)NC(=O)C2=C(C=CC(=C2)SC)Cl

InChI

InChI=1S/C16H13Cl2NO4S/c1-23-14-7-13(12(18)6-10(14)16(21)22)19-15(20)9-5-8(24-2)3-4-11(9)17/h3-7H,1-2H3,(H,19,20)(H,21,22)