2-[[4-(4-chloranylsulfanylphenyl)-2-fluoranyl-phenyl]carbamoyl]cyclopentene-1-carboxylic acid

Systemtic Name: 2-[[4-(4-chloranylsulfanylphenyl)-2-fluoranyl-phenyl]carbamoyl]cyclopentene-1-carboxylic acid Openeye Name: 2-[[4-(4-chlorosulfanylphenyl)-2-fluoro-phenyl]carbamoyl]cyclopentene-1-carboxylic acid CAS Name: 2-[[4-[4-(chlorothio)phenyl]-2-fluoroanilino]-oxomethyl]-1-cyclopentenecarboxylic acid IUPAC Name: 2-[[4-(4-chlorosulfanylphenyl)-2-fluorophenyl]carbamoyl]cyclopentene-1-carboxylic acid Traditional Name: 2-[[4-[4-(chlorothio)phenyl]-2-fluoro-phenyl]carbamoyl]cyclopentene-1-carboxylic acid Formula: C19H15ClFNO3S MolecularWeight: 391.843703

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)C(=O)O)C(=O)NC2=C(C=C(C=C2)C3=CC=C(C=C3)SCl)F

Isomeric SMILES

C1CC(=C(C1)C(=O)O)C(=O)NC2=C(C=C(C=C2)C3=CC=C(C=C3)SCl)F

InChI

InChI=1S/C19H15ClFNO3S/c20-26-13-7-4-11(5-8-13)12-6-9-17(16(21)10-12)22-18(23)14-2-1-3-15(14)19(24)25/h4-10H,1-3H2,(H,22,23)(H,24,25)