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

Systemtic Name: (2S)-4-azaniumyl-2-phenyl-butanoate Openeye Name: (2S)-4-azaniumyl-2-phenyl-butanoate CAS Name: (2S)-4-ammonio-2-phenylbutanoate IUPAC Name: (2S)-4-azaniumyl-2-phenylbutanoate Traditional Name: (2S)-4-ammonio-2-phenyl-butyrate Formula: C10H13NO2 MolecularWeight: 179.21572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO2/c11-7-6-9(10(12)13)8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m0/s1