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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)(C(=O)[O-])[NH3+]

Isomeric SMILES

CC[C@](C1=CC=C(C=C1)C)(C(=O)[O-])[NH3+]

InChI

InChI=1S/C11H15NO2/c1-3-11(12,10(13)14)9-6-4-8(2)5-7-9/h4-7H,3,12H2,1-2H3,(H,13,14)/t11-/m0/s1