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

Systemtic Name: 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]propanoic acid Openeye Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]propanoic acid CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]propanoic acid Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]propionic acid Formula: C12H10ClNO3S MolecularWeight: 283.7307

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10ClNO3S/c1-6(12(16)17)14-11(15)10-9(13)7-4-2-3-5-8(7)18-10/h2-6H,1H3,(H,14,15)(H,16,17)