4-methyl-3-oxidanylidene-4-(1,2,4-triazol-1-yl)pentanenitrile

Systemtic Name: 4-methyl-3-oxidanylidene-4-(1,2,4-triazol-1-yl)pentanenitrile Openeye Name: 4-methyl-3-oxo-4-(1,2,4-triazol-1-yl)pentanenitrile CAS Name: 4-methyl-3-oxo-4-(1,2,4-triazol-1-yl)pentanenitrile IUPAC Name: 4-methyl-3-oxo-4-(1,2,4-triazol-1-yl)pentanenitrile Traditional Name: 3-keto-4-methyl-4-(1,2,4-triazol-1-yl)valeronitrile Formula: C8H10N4O MolecularWeight: 178.1912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10N4O/c1-8(2,7(13)3-4-9)12-6-10-5-11-12/h5-6H,3H2,1-2H3