5,5-dimethyl-4-oxidanylidene-3-(1,2,4-triazol-1-yl)hexanal

Systemtic Name: 5,5-dimethyl-4-oxidanylidene-3-(1,2,4-triazol-1-yl)hexanal Openeye Name: 5,5-dimethyl-4-oxo-3-(1,2,4-triazol-1-yl)hexanal CAS Name: 5,5-dimethyl-4-oxo-3-(1,2,4-triazol-1-yl)hexanal IUPAC Name: 5,5-dimethyl-4-oxo-3-(1,2,4-triazol-1-yl)hexanal Traditional Name: 4-keto-5,5-dimethyl-3-(1,2,4-triazol-1-yl)hexanal Formula: C10H15N3O2 MolecularWeight: 209.245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(CC=O)N1C=NC=N1

Isomeric SMILES

CC(C)(C)C(=O)C(CC=O)N1C=NC=N1

InChI

InChI=1S/C10H15N3O2/c1-10(2,3)9(15)8(4-5-14)13-7-11-6-12-13/h5-8H,4H2,1-3H3