3-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]butanoic acid

Systemtic Name: 3-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]butanoic acid Openeye Name: 3-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]butanoic acid CAS Name: 3-[[(3,6-dichloro-1-benzothiophen-2-yl)-oxomethyl]amino]butanoic acid IUPAC Name: 3-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]butanoic acid Traditional Name: 3-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]butyric acid Formula: C13H11Cl2NO3S MolecularWeight: 332.20234

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)C1=C(C2=C(S1)C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(CC(=O)O)NC(=O)C1=C(C2=C(S1)C=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H11Cl2NO3S/c1-6(4-10(17)18)16-13(19)12-11(15)8-3-2-7(14)5-9(8)20-12/h2-3,5-6H,4H2,1H3,(H,16,19)(H,17,18)