3-[(5-carboxy-4-chloranyl-2-fluoranyl-phenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(5-carboxy-4-chloranyl-2-fluoranyl-phenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(5-carboxy-4-chloro-2-fluoro-phenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[(5-carboxy-4-chloro-2-fluorophenyl)sulfonylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(5-carboxy-4-chloro-2-fluorophenyl)sulfonylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(5-carboxy-4-chloro-2-fluoro-phenyl)sulfonylamino]-5-phenyl-2-thenoic acid Formula: C18H11ClFNO6S2 MolecularWeight: 455.864443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NS(=O)(=O)C3=C(C=C(C(=C3)C(=O)O)Cl)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NS(=O)(=O)C3=C(C=C(C(=C3)C(=O)O)Cl)F

InChI

InChI=1S/C18H11ClFNO6S2/c19-11-7-12(20)15(6-10(11)17(22)23)29(26,27)21-13-8-14(28-16(13)18(24)25)9-4-2-1-3-5-9/h1-8,21H,(H,22,23)(H,24,25)