(2R,3R)-2-azaniumyl-3-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-propanoate

Systemtic Name: (2R,3R)-2-azaniumyl-3-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-propanoate Openeye Name: (2R,3R)-2-azaniumyl-3-(3,4-dihydroxyphenyl)-3-hydroxy-propanoate CAS Name: (2R,3R)-2-ammonio-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoate IUPAC Name: (2R,3R)-2-azaniumyl-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoate Traditional Name: (2R,3R)-2-ammonio-3-(3,4-dihydroxyphenyl)-3-hydroxy-propionate Formula: C9H11NO5 MolecularWeight: 213.18734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO5/c10-7(9(14)15)8(13)4-1-2-5(11)6(12)3-4/h1-3,7-8,11-13H,10H2,(H,14,15)/t7-,8-/m1/s1