(3S)-3-azaniumyl-4-(2-methylphenyl)butanoate

Systemtic Name: (3S)-3-azaniumyl-4-(2-methylphenyl)butanoate Openeye Name: (3S)-3-azaniumyl-4-(o-tolyl)butanoate CAS Name: (3S)-3-ammonio-4-(2-methylphenyl)butanoate IUPAC Name: (3S)-3-azaniumyl-4-(2-methylphenyl)butanoate Traditional Name: (3S)-3-ammonio-4-(o-tolyl)butyrate Formula: C11H15NO2 MolecularWeight: 193.2423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(CC(=O)[O-])[NH3+]

Isomeric SMILES

CC1=CC=CC=C1C[C@@H](CC(=O)[O-])[NH3+]

InChI

InChI=1S/C11H15NO2/c1-8-4-2-3-5-9(8)6-10(12)7-11(13)14/h2-5,10H,6-7,12H2,1H3,(H,13,14)/t10-/m0/s1