2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)-methyl-amino]acetic acid CAS Name: 2-[[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)-methylamino]acetic acid Traditional Name: 2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)-methyl-amino]acetic acid Formula: C12H9ClFNO3S MolecularWeight: 301.721163

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C1=C(C2=C(S1)C=C(C=C2)F)Cl

Isomeric SMILES

CN(CC(=O)O)C(=O)C1=C(C2=C(S1)C=C(C=C2)F)Cl

InChI

InChI=1S/C12H9ClFNO3S/c1-15(5-9(16)17)12(18)11-10(13)7-3-2-6(14)4-8(7)19-11/h2-4H,5H2,1H3,(H,16,17)