(2S,3S)-2-azanyl-3-[3,4-bis(oxidanyl)phenyl]-2,3-dideuterio-propanoic acid

Systemtic Name: (2S,3S)-2-azanyl-3-[3,4-bis(oxidanyl)phenyl]-2,3-dideuterio-propanoic acid Openeye Name: (2S,3S)-2-amino-2,3-dideuterio-3-(3,4-dihydroxyphenyl)propanoic acid CAS Name: (2S,3S)-2-amino-2,3-dideuterio-3-(3,4-dihydroxyphenyl)propanoic acid IUPAC Name: (2S,3S)-2-amino-2,3-dideuterio-3-(3,4-dihydroxyphenyl)propanoic acid Traditional Name: (2S,3S)-2-amino-2,3-dideuterio-3-(3,4-dihydroxyphenyl)propionic acid Formula: C9H11NO4 MolecularWeight: 199.200264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(C(=O)O)N)O)O

Isomeric SMILES

[H][C@]([2H])(C1=CC(=C(C=C1)O)O)[C@@]([2H])(C(=O)O)N

InChI

InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m0/s1/i3D,6D/t3-,6-