(2S)-2-(azaniumylmethyl)-3-(4-chlorophenyl)propanoate

Systemtic Name: (2S)-2-(azaniumylmethyl)-3-(4-chlorophenyl)propanoate Openeye Name: (2S)-2-(azaniumylmethyl)-3-(4-chlorophenyl)propanoate CAS Name: (2S)-2-(ammoniomethyl)-3-(4-chlorophenyl)propanoate IUPAC Name: (2S)-2-(azaniumylmethyl)-3-(4-chlorophenyl)propanoate Traditional Name: (2S)-2-(ammoniomethyl)-3-(4-chlorophenyl)propionate Formula: C10H12ClNO2 MolecularWeight: 213.66078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C[NH3+])C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](C[NH3+])C(=O)[O-])Cl

InChI

InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)5-8(6-12)10(13)14/h1-4,8H,5-6,12H2,(H,13,14)/t8-/m0/s1