5-(2,2-dimethylpropyl)-1,2-dihydro-1,2,4-triazol-3-one

Systemtic Name: 5-(2,2-dimethylpropyl)-1,2-dihydro-1,2,4-triazol-3-one Openeye Name: 5-(2,2-dimethylpropyl)-1,2-dihydro-1,2,4-triazol-3-one CAS Name: 5-(2,2-dimethylpropyl)-1,2-dihydro-1,2,4-triazol-3-one IUPAC Name: 5-(2,2-dimethylpropyl)-1,2-dihydro-1,2,4-triazol-3-one Traditional Name: 5-neopentyl-1,2-dihydro-1,2,4-triazol-3-one Formula: C7H13N3O MolecularWeight: 155.19762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=NC(=O)NN1

Isomeric SMILES

CC(C)(C)CC1=NC(=O)NN1

InChI

InChI=1S/C7H13N3O/c1-7(2,3)4-5-8-6(11)10-9-5/h4H2,1-3H3,(H2,8,9,10,11)