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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2S1)C

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2S1)C

InChI

InChI=1S/C14H15NO3S/c1-3-10(14(17)18)15-13(16)12-8(2)9-6-4-5-7-11(9)19-12/h4-7,10H,3H2,1-2H3,(H,15,16)(H,17,18)