3-[(2-methylphenyl)methylazaniumyl]propanoate

Systemtic Name: 3-[(2-methylphenyl)methylazaniumyl]propanoate Openeye Name: 3-(o-tolylmethylammonio)propanoate CAS Name: 3-[(2-methylphenyl)methylammonio]propanoate IUPAC Name: 3-[(2-methylphenyl)methylazaniumyl]propanoate Traditional Name: 3-[(2-methylbenzyl)ammonio]propionate Formula: C11H15NO2 MolecularWeight: 193.2423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH2+]CCC(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C[NH2+]CCC(=O)[O-]

InChI

InChI=1S/C11H15NO2/c1-9-4-2-3-5-10(9)8-12-7-6-11(13)14/h2-5,12H,6-8H2,1H3,(H,13,14)