5-methyl-4-[[methyl-(phenylmethyl)azaniumyl]methyl]furan-2-carboxylate

Systemtic Name: 5-methyl-4-[[methyl-(phenylmethyl)azaniumyl]methyl]furan-2-carboxylate Openeye Name: 4-[[benzyl(methyl)ammonio]methyl]-5-methyl-furan-2-carboxylate CAS Name: 5-methyl-4-[[methyl-(phenylmethyl)ammonio]methyl]-2-furancarboxylate IUPAC Name: 4-[[benzyl(methyl)azaniumyl]methyl]-5-methylfuran-2-carboxylate Traditional Name: 4-[[benzyl(methyl)ammonio]methyl]-5-methyl-2-furoate Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)[O-])C[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(O1)C(=O)[O-])C[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C15H17NO3/c1-11-13(8-14(19-11)15(17)18)10-16(2)9-12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3,(H,17,18)