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4-[(5-bromanylthiophen-2-yl)methylamino]butanoic acid

4-[(5-bromanylthiophen-2-yl)methylamino]butanoic acid

Systemtic Name:4-[(5-bromanylthiophen-2-yl)methylamino]butanoic acid
Openeye Name:4-[(5-bromo-2-thienyl)methylamino]butanoic acid
CAS Name:4-[(5-bromo-2-thiophenyl)methylamino]butanoic acid
IUPAC Name:4-[(5-bromothiophen-2-yl)methylamino]butanoic acid
Traditional Name:4-[(5-bromo-2-thienyl)methylamino]butyric acid
Formula: C9H12BrNO2S
MolecularWeight: 278.16608
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)CNCCCC(=O)O


Isomeric SMILES

C1=C(SC(=C1)Br)CNCCCC(=O)O


InChI

InChI=1S/C9H12BrNO2S/c10-8-4-3-7(14-8)6-11-5-1-2-9(12)13/h3-4,11H,1-2,5-6H2,(H,12,13)


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