(2R,3R)-2-azaniumyl-3-(2,6-dimethylphenyl)butanoate

Systemtic Name: (2R,3R)-2-azaniumyl-3-(2,6-dimethylphenyl)butanoate Openeye Name: (2R,3R)-2-azaniumyl-3-(2,6-dimethylphenyl)butanoate CAS Name: (2R,3R)-2-ammonio-3-(2,6-dimethylphenyl)butanoate IUPAC Name: (2R,3R)-2-azaniumyl-3-(2,6-dimethylphenyl)butanoate Traditional Name: (2R,3R)-2-ammonio-3-(2,6-dimethylphenyl)butyrate Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(C)C(C(=O)[O-])[NH3+]

Isomeric SMILES

CC1=C(C(=CC=C1)C)[C@@H](C)[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C12H17NO2/c1-7-5-4-6-8(2)10(7)9(3)11(13)12(14)15/h4-6,9,11H,13H2,1-3H3,(H,14,15)/t9-,11-/m1/s1