2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]-3-hydroxy-propanoic acid CAS Name: 2-[[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]-3-hydroxypropanoic acid Traditional Name: 2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]-3-hydroxy-propionic acid Formula: C12H9ClFNO4S MolecularWeight: 317.720563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1F)SC(=C2Cl)C(=O)NC(CO)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1F)SC(=C2Cl)C(=O)NC(CO)C(=O)O

InChI

InChI=1S/C12H9ClFNO4S/c13-9-6-2-1-5(14)3-8(6)20-10(9)11(17)15-7(4-16)12(18)19/h1-3,7,16H,4H2,(H,15,17)(H,18,19)