4-[[3,7-bis(chloranyl)-6-methoxy-1-benzothiophen-2-yl]carbonylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[[3,7-bis(chloranyl)-6-methoxy-1-benzothiophen-2-yl]carbonylamino]-3-methyl-benzoic acid Openeye Name: 4-[(3,7-dichloro-6-methoxy-benzothiophene-2-carbonyl)amino]-3-methyl-benzoic acid CAS Name: 4-[[(3,7-dichloro-6-methoxy-1-benzothiophen-2-yl)-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[(3,7-dichloro-6-methoxy-1-benzothiophene-2-carbonyl)amino]-3-methylbenzoic acid Traditional Name: 4-[(3,7-dichloro-6-methoxy-benzothiophene-2-carbonyl)amino]-3-methyl-benzoic acid Formula: C18H13Cl2NO4S MolecularWeight: 410.27112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=C(C3=C(S2)C(=C(C=C3)OC)Cl)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=C(C3=C(S2)C(=C(C=C3)OC)Cl)Cl

InChI

InChI=1S/C18H13Cl2NO4S/c1-8-7-9(18(23)24)3-5-11(8)21-17(22)16-13(19)10-4-6-12(25-2)14(20)15(10)26-16/h3-7H,1-2H3,(H,21,22)(H,23,24)