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

Systemtic Name: 3-[(4-fluoranyl-3-methyl-1-benzothiophen-2-yl)carbonylamino]butanoic acid Openeye Name: 3-[(4-fluoro-3-methyl-benzothiophene-2-carbonyl)amino]butanoic acid CAS Name: 3-[[(4-fluoro-3-methyl-1-benzothiophen-2-yl)-oxomethyl]amino]butanoic acid IUPAC Name: 3-[(4-fluoro-3-methyl-1-benzothiophene-2-carbonyl)amino]butanoic acid Traditional Name: 3-[(4-fluoro-3-methyl-benzothiophene-2-carbonyl)amino]butyric acid Formula: C14H14FNO3S MolecularWeight: 295.329263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC(C)CC(=O)O

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC(C)CC(=O)O

InChI

InChI=1S/C14H14FNO3S/c1-7(6-11(17)18)16-14(19)13-8(2)12-9(15)4-3-5-10(12)20-13/h3-5,7H,6H2,1-2H3,(H,16,19)(H,17,18)