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

Systemtic Name: 3-[(3-methyl-1-benzothiophen-2-yl)carbonylamino]butanoic acid Openeye Name: 3-[(3-methylbenzothiophene-2-carbonyl)amino]butanoic acid CAS Name: 3-[[(3-methyl-1-benzothiophen-2-yl)-oxomethyl]amino]butanoic acid IUPAC Name: 3-[(3-methyl-1-benzothiophene-2-carbonyl)amino]butanoic acid Traditional Name: 3-[(3-methylbenzothiophene-2-carbonyl)amino]butyric acid Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO3S/c1-8(7-12(16)17)15-14(18)13-9(2)10-5-3-4-6-11(10)19-13/h3-6,8H,7H2,1-2H3,(H,15,18)(H,16,17)