(4-azanyl-5-oxidanylidene-3-phenyl-1,2,4-triazol-1-yl) propanoate

Systemtic Name: (4-azanyl-5-oxidanylidene-3-phenyl-1,2,4-triazol-1-yl) propanoate Openeye Name: (4-amino-5-oxo-3-phenyl-1,2,4-triazol-1-yl) propanoate CAS Name: propanoic acid (4-amino-5-oxo-3-phenyl-1,2,4-triazol-1-yl) ester IUPAC Name: (4-amino-5-oxo-3-phenyl-1,2,4-triazol-1-yl) propanoate Traditional Name: propionic acid (4-amino-5-keto-3-phenyl-1,2,4-triazol-1-yl) ester Formula: C11H12N4O3 MolecularWeight: 248.23798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ON1C(=O)N(C(=N1)C2=CC=CC=C2)N

Isomeric SMILES

CCC(=O)ON1C(=O)N(C(=N1)C2=CC=CC=C2)N

InChI

InChI=1S/C11H12N4O3/c1-2-9(16)18-15-11(17)14(12)10(13-15)8-6-4-3-5-7-8/h3-7H,2,12H2,1H3