3-[(4-fluoranyl-1-benzothiophen-2-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[(4-fluoranyl-1-benzothiophen-2-yl)carbonylamino]propanoic acid Openeye Name: 3-[(4-fluorobenzothiophene-2-carbonyl)amino]propanoic acid CAS Name: 3-[[(4-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(4-fluoro-1-benzothiophene-2-carbonyl)amino]propanoic acid Traditional Name: 3-[(4-fluorobenzothiophene-2-carbonyl)amino]propionic acid Formula: C12H10FNO3S MolecularWeight: 267.276103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=O)NCCC(=O)O)F

Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=O)NCCC(=O)O)F

InChI

InChI=1S/C12H10FNO3S/c13-8-2-1-3-9-7(8)6-10(18-9)12(17)14-5-4-11(15)16/h1-3,6H,4-5H2,(H,14,17)(H,15,16)