2-azanyl-3-[5-(1-methylimidazol-2-yl)-3-oxidanylidene-1,2-oxazol-4-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[5-(1-methylimidazol-2-yl)-3-oxidanylidene-1,2-oxazol-4-yl]propanoic acid Openeye Name: 2-amino-3-[5-(1-methylimidazol-2-yl)-3-oxo-isoxazol-4-yl]propanoic acid CAS Name: 2-amino-3-[5-(1-methyl-2-imidazolyl)-3-oxo-4-isoxazolyl]propanoic acid IUPAC Name: 2-amino-3-[5-(1-methylimidazol-2-yl)-3-oxo-1,2-oxazol-4-yl]propanoic acid Traditional Name: 2-amino-3-[3-keto-5-(1-methylimidazol-2-yl)-4-isoxazolin-4-yl]propionic acid Formula: C10H12N4O4 MolecularWeight: 252.22668

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C2=C(C(=O)NO2)CC(C(=O)O)N

Isomeric SMILES

CN1C=CN=C1C2=C(C(=O)NO2)CC(C(=O)O)N

InChI

InChI=1S/C10H12N4O4/c1-14-3-2-12-8(14)7-5(9(15)13-18-7)4-6(11)10(16)17/h2-3,6H,4,11H2,1H3,(H,13,15)(H,16,17)