3-methyl-5-oxidanylidene-1,2-dihydropyrrole-4-carbonitrile

Systemtic Name: 3-methyl-5-oxidanylidene-1,2-dihydropyrrole-4-carbonitrile Openeye Name: 3-methyl-5-oxo-1,2-dihydropyrrole-4-carbonitrile CAS Name: 3-methyl-5-oxo-1,2-dihydropyrrole-4-carbonitrile IUPAC Name: 3-methyl-5-oxo-1,2-dihydropyrrole-4-carbonitrile Traditional Name: 2-keto-4-methyl-3-pyrroline-3-carbonitrile Formula: C6H6N2O MolecularWeight: 123.117295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC1)C#N

Isomeric SMILES

CC1=[13C](C(=O)NC1)C#N

InChI

InChI=1S/C6H6N2O/c1-4-3-8-6(9)5(4)2-7/h3H2,1H3,(H,8,9)/i5+1