4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(3-chlorobenzothiophene-2-carbonyl)-methyl-amino]butanoic acid CAS Name: 4-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(3-chloro-1-benzothiophene-2-carbonyl)-methylamino]butanoic acid Traditional Name: 4-[(3-chlorobenzothiophene-2-carbonyl)-methyl-amino]butyric acid Formula: C14H14ClNO3S MolecularWeight: 311.78386

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CN(CCCC(=O)O)C(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C14H14ClNO3S/c1-16(8-4-7-11(17)18)14(19)13-12(15)9-5-2-3-6-10(9)20-13/h2-3,5-6H,4,7-8H2,1H3,(H,17,18)