azanium 2,3-bis(chloranyl)-3-phenyl-propanoate

Systemtic Name: azanium 2,3-bis(chloranyl)-3-phenyl-propanoate Openeye Name: ammonium 2,3-dichloro-3-phenyl-propanoate CAS Name: ammonium 2,3-dichloro-3-phenylpropanoate IUPAC Name: azanium 2,3-dichloro-3-phenylpropanoate Traditional Name: ammonium 2,3-dichloro-3-phenyl-propionate Formula: C9H11Cl2NO2 MolecularWeight: 236.09514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)[O-])Cl)Cl.[NH4+]

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)[O-])Cl)Cl.[NH4+]

InChI

InChI=1S/C9H8Cl2O2.H3N/c10-7(8(11)9(12)13)6-4-2-1-3-5-6;/h1-5,7-8H,(H,12,13);1H3