4-[furan-2-ylmethyl(methyl)azaniumyl]butanoate

Systemtic Name: 4-[furan-2-ylmethyl(methyl)azaniumyl]butanoate Openeye Name: 4-[2-furylmethyl(methyl)ammonio]butanoate CAS Name: 4-[2-furanylmethyl(methyl)ammonio]butanoate IUPAC Name: 4-[furan-2-ylmethyl(methyl)azaniumyl]butanoate Traditional Name: 4-[2-furfuryl(methyl)ammonio]butyrate Formula: C10H15NO3 MolecularWeight: 197.231

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCC(=O)[O-])CC1=CC=CO1

Isomeric SMILES

C[NH+](CCCC(=O)[O-])CC1=CC=CO1

InChI

InChI=1S/C10H15NO3/c1-11(6-2-5-10(12)13)8-9-4-3-7-14-9/h3-4,7H,2,5-6,8H2,1H3,(H,12,13)