5-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-methyl-2-oxidanyl-benzoic acid

Systemtic Name: 5-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-methyl-2-oxidanyl-benzoic acid Openeye Name: 5-[(3-chlorobenzothiophene-2-carbonyl)amino]-2-hydroxy-3-methyl-benzoic acid CAS Name: 5-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-2-hydroxy-3-methylbenzoic acid IUPAC Name: 5-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-2-hydroxy-3-methylbenzoic acid Traditional Name: 5-[(3-chlorobenzothiophene-2-carbonyl)amino]-2-hydroxy-3-methyl-benzoic acid Formula: C17H12ClNO4S MolecularWeight: 361.79948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)O)O

Isomeric SMILES

CC1=C(C(=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)O)O

InChI

InChI=1S/C17H12ClNO4S/c1-8-6-9(7-11(14(8)20)17(22)23)19-16(21)15-13(18)10-4-2-3-5-12(10)24-15/h2-7,20H,1H3,(H,19,21)(H,22,23)