(2S)-2-azaniumyl-3-(3-chlorophenyl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3-(3-chlorophenyl)propanoate Openeye Name: (2S)-2-azaniumyl-3-(3-chlorophenyl)propanoate CAS Name: (2S)-2-ammonio-3-(3-chlorophenyl)propanoate IUPAC Name: (2S)-2-azaniumyl-3-(3-chlorophenyl)propanoate Traditional Name: (2S)-2-ammonio-3-(3-chlorophenyl)propionate Formula: C9H10ClNO2 MolecularWeight: 199.6342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10ClNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1