[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC=C(C=C1)N2C=NC=N2

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)C1=CC=C(C=C1)N2C=NC=N2

InChI

InChI=1S/C12H12N4O3/c1-8(11(13)17)19-12(18)9-2-4-10(5-3-9)16-7-14-6-15-16/h2-8H,1H3,(H2,13,17)/t8-/m1/s1