(2S)-3-(3-methylimidazol-4-yl)-2-(2-oxidanylprop-2-enoylamino)propanoic acid

Systemtic Name: (2S)-3-(3-methylimidazol-4-yl)-2-(2-oxidanylprop-2-enoylamino)propanoic acid Openeye Name: (2S)-2-(2-hydroxyprop-2-enoylamino)-3-(3-methylimidazol-4-yl)propanoic acid CAS Name: (2S)-2-[(2-hydroxy-1-oxoprop-2-enyl)amino]-3-(3-methyl-4-imidazolyl)propanoic acid IUPAC Name: (2S)-2-(2-hydroxyprop-2-enoylamino)-3-(3-methylimidazol-4-yl)propanoic acid Traditional Name: (2S)-2-[(2-hydroxyacryloyl)amino]-3-(3-methylimidazol-4-yl)propionic acid Formula: C10H13N3O4 MolecularWeight: 239.22792

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CC(C(=O)O)NC(=O)C(=C)O

Isomeric SMILES

CN1C=NC=C1C[C@@H](C(=O)O)NC(=O)C(=C)O

InChI

InChI=1S/C10H13N3O4/c1-6(14)9(15)12-8(10(16)17)3-7-4-11-5-13(7)2/h4-5,8,14H,1,3H2,2H3,(H,12,15)(H,16,17)/t8-/m0/s1