3-[(3-methylphenyl)methylazaniumyl]propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH2+]CCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)C[NH2+]CCC(=O)[O-]

InChI

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