(2R)-2-azaniumyl-2-(3,5-dimethylphenyl)ethanoate

Systemtic Name: (2R)-2-azaniumyl-2-(3,5-dimethylphenyl)ethanoate Openeye Name: (2R)-2-azaniumyl-2-(3,5-dimethylphenyl)acetate CAS Name: (2R)-2-ammonio-2-(3,5-dimethylphenyl)acetate IUPAC Name: (2R)-2-azaniumyl-2-(3,5-dimethylphenyl)acetate Traditional Name: (2R)-2-ammonio-2-(3,5-dimethylphenyl)acetate Formula: C10H13NO2 MolecularWeight: 179.21572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO2/c1-6-3-7(2)5-8(4-6)9(11)10(12)13/h3-5,9H,11H2,1-2H3,(H,12,13)/t9-/m1/s1