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

Systemtic Name: 4-[(5-bromanylfuran-2-yl)methylamino]butanoic acid Openeye Name: 4-[(5-bromo-2-furyl)methylamino]butanoic acid CAS Name: 4-[(5-bromo-2-furanyl)methylamino]butanoic acid IUPAC Name: 4-[(5-bromofuran-2-yl)methylamino]butanoic acid Traditional Name: 4-[(5-bromo-2-furyl)methylamino]butyric acid Formula: C9H12BrNO3 MolecularWeight: 262.10048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12BrNO3/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)