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

Systemtic Name: 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]butanoic acid Openeye Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]butanoic acid CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]butanoic acid Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]butyric acid Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12ClNO3S/c1-2-8(13(17)18)15-12(16)11-10(14)7-5-3-4-6-9(7)19-11/h3-6,8H,2H2,1H3,(H,15,16)(H,17,18)