1,8-dimethyl-3-oxidanylidene-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile

Systemtic Name: 1,8-dimethyl-3-oxidanylidene-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile Openeye Name: 1,8-dimethyl-3-oxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile CAS Name: 1,8-dimethyl-3-oxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile IUPAC Name: 1,8-dimethyl-3-oxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile Traditional Name: 3-keto-1,8-dimethyl-5,6,7,8-tetrahydro-2H-isoquinoline-4-carbonitrile Formula: C12H14N2O MolecularWeight: 202.25236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC2=C(C(=O)NC(=C12)C)C#N

Isomeric SMILES

CC1CCCC2=C(C(=O)NC(=C12)C)C#N

InChI

InChI=1S/C12H14N2O/c1-7-4-3-5-9-10(6-13)12(15)14-8(2)11(7)9/h7H,3-5H2,1-2H3,(H,14,15)