(2R)-2-azaniumyl-3-(3-chloranyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: (2R)-2-azaniumyl-3-(3-chloranyl-4-oxidanyl-phenyl)propanoate Openeye Name: (2R)-2-azaniumyl-3-(3-chloro-4-hydroxy-phenyl)propanoate CAS Name: (2R)-2-ammonio-3-(3-chloro-4-hydroxyphenyl)propanoate IUPAC Name: (2R)-2-azaniumyl-3-(3-chloro-4-hydroxyphenyl)propanoate Traditional Name: (2R)-2-ammonio-3-(3-chloro-4-hydroxy-phenyl)propionate Formula: C9H10ClNO3 MolecularWeight: 215.6336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10ClNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m1/s1