(2S)-2-benzamido-2,3-dideuterio-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: (2S)-2-benzamido-2,3-dideuterio-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: (2S)-2-benzamido-2,3-dideuterio-3-(1H-imidazol-5-yl)propanoic acid CAS Name: (2S)-2-benzamido-2,3-dideuterio-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: (2S)-2-benzamido-2,3-dideuterio-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: (2S)-2-benzamido-2,3-dideuterio-3-(1H-imidazol-5-yl)propionic acid Formula: C13H13N3O3 MolecularWeight: 261.272944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

[2H]C(C1=CN=CN1)[C@@]([2H])(C(=O)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H13N3O3/c17-12(9-4-2-1-3-5-9)16-11(13(18)19)6-10-7-14-8-15-10/h1-5,7-8,11H,6H2,(H,14,15)(H,16,17)(H,18,19)/t11-/m0/s1/i6D,11D/t6?,11-