(2S)-2-[(2-chloranyl-6-fluoranyl-phenyl)methylazaniumyl]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[(2-chloranyl-6-fluoranyl-phenyl)methylazaniumyl]-3-phenyl-propanoate Openeye Name: (2S)-2-[(2-chloro-6-fluoro-phenyl)methylammonio]-3-phenyl-propanoate CAS Name: (2S)-2-[(2-chloro-6-fluorophenyl)methylammonio]-3-phenylpropanoate IUPAC Name: (2S)-2-[(2-chloro-6-fluorophenyl)methylazaniumyl]-3-phenylpropanoate Traditional Name: (2S)-2-[(2-chloro-6-fluoro-benzyl)ammonio]-3-phenyl-propionate Formula: C16H15ClFNO2 MolecularWeight: 307.747203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])[NH2+]CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])[NH2+]CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C16H15ClFNO2/c17-13-7-4-8-14(18)12(13)10-19-15(16(20)21)9-11-5-2-1-3-6-11/h1-8,15,19H,9-10H2,(H,20,21)/t15-/m0/s1