4-[4-(5-bromanylthiophen-2-yl)butanoyl-methyl-amino]butanoic acid

Systemtic Name: 4-[4-(5-bromanylthiophen-2-yl)butanoyl-methyl-amino]butanoic acid Openeye Name: 4-[4-(5-bromo-2-thienyl)butanoyl-methyl-amino]butanoic acid CAS Name: 4-[[4-(5-bromo-2-thiophenyl)-1-oxobutyl]-methylamino]butanoic acid IUPAC Name: 4-[4-(5-bromothiophen-2-yl)butanoyl-methylamino]butanoic acid Traditional Name: 4-[4-(5-bromo-2-thienyl)butanoyl-methyl-amino]butyric acid Formula: C13H18BrNO3S MolecularWeight: 348.25592

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)CCCC1=CC=C(S1)Br

Isomeric SMILES

CN(CCCC(=O)O)C(=O)CCCC1=CC=C(S1)Br

InChI

InChI=1S/C13H18BrNO3S/c1-15(9-3-6-13(17)18)12(16)5-2-4-10-7-8-11(14)19-10/h7-8H,2-6,9H2,1H3,(H,17,18)