5-[(5-chloranylthiophen-2-yl)methylamino]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[(5-chloranylthiophen-2-yl)methylamino]-2-fluoranyl-benzoic acid Openeye Name: 5-[(5-chloro-2-thienyl)methylamino]-2-fluoro-benzoic acid CAS Name: 5-[(5-chloro-2-thiophenyl)methylamino]-2-fluorobenzoic acid IUPAC Name: 5-[(5-chlorothiophen-2-yl)methylamino]-2-fluorobenzoic acid Traditional Name: 5-[(5-chloro-2-thienyl)methylamino]-2-fluoro-benzoic acid Formula: C12H9ClFNO2S MolecularWeight: 285.721763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCC2=CC=C(S2)Cl)C(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1NCC2=CC=C(S2)Cl)C(=O)O)F

InChI

InChI=1S/C12H9ClFNO2S/c13-11-4-2-8(18-11)6-15-7-1-3-10(14)9(5-7)12(16)17/h1-5,15H,6H2,(H,16,17)