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

Systemtic Name: 2-azanyl-3-[5-(2-methyl-1,2,3,4-tetrazol-5-yl)-3-oxidanylidene-1,2-oxazol-4-yl]propanoic acid Openeye Name: 2-amino-3-[5-(2-methyltetrazol-5-yl)-3-oxo-isoxazol-4-yl]propanoic acid CAS Name: 2-amino-3-[5-(2-methyl-5-tetrazolyl)-3-oxo-4-isoxazolyl]propanoic acid IUPAC Name: 2-amino-3-[5-(2-methyltetrazol-5-yl)-3-oxo-1,2-oxazol-4-yl]propanoic acid Traditional Name: 2-amino-3-[3-keto-5-(2-methyltetrazol-5-yl)-4-isoxazolin-4-yl]propionic acid Formula: C8H10N6O4 MolecularWeight: 254.2028

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Descriptors Computed from Structure

Canonical SMILES:

CN1N=C(N=N1)C2=C(C(=O)NO2)CC(C(=O)O)N

Isomeric SMILES

CN1N=C(N=N1)C2=C(C(=O)NO2)CC(C(=O)O)N

InChI

InChI=1S/C8H10N6O4/c1-14-11-6(10-13-14)5-3(7(15)12-18-5)2-4(9)8(16)17/h4H,2,9H2,1H3,(H,12,15)(H,16,17)