(2S)-2-(azaniumylmethyl)-3-(2-bromophenyl)propanoate

Systemtic Name: (2S)-2-(azaniumylmethyl)-3-(2-bromophenyl)propanoate Openeye Name: (2S)-2-(azaniumylmethyl)-3-(2-bromophenyl)propanoate CAS Name: (2S)-2-(ammoniomethyl)-3-(2-bromophenyl)propanoate IUPAC Name: (2S)-2-(azaniumylmethyl)-3-(2-bromophenyl)propanoate Traditional Name: (2S)-2-(ammoniomethyl)-3-(2-bromophenyl)propionate Formula: C10H12BrNO2 MolecularWeight: 258.11178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12BrNO2/c11-9-4-2-1-3-7(9)5-8(6-12)10(13)14/h1-4,8H,5-6,12H2,(H,13,14)/t8-/m0/s1