(1E)-1-(2-cyclohexyl-2-oxidanylidene-ethylidene)-3,3,6-trimethyl-2,4-dihydroisoquinoline-7-carbonitrile

Systemtic Name: (1E)-1-(2-cyclohexyl-2-oxidanylidene-ethylidene)-3,3,6-trimethyl-2,4-dihydroisoquinoline-7-carbonitrile Openeye Name: (1E)-1-(2-cyclohexyl-2-oxo-ethylidene)-3,3,6-trimethyl-2,4-dihydroisoquinoline-7-carbonitrile CAS Name: (1E)-1-(2-cyclohexyl-2-oxoethylidene)-3,3,6-trimethyl-2,4-dihydroisoquinoline-7-carbonitrile IUPAC Name: (1E)-1-(2-cyclohexyl-2-oxoethylidene)-3,3,6-trimethyl-2,4-dihydroisoquinoline-7-carbonitrile Traditional Name: (1E)-1-(2-cyclohexyl-2-keto-ethylidene)-3,3,6-trimethyl-2,4-dihydroisoquinoline-7-carbonitrile Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C#N)C(=CC(=O)C3CCCCC3)NC(C2)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C#N)/C(=C\C(=O)C3CCCCC3)/NC(C2)(C)C

InChI

InChI=1S/C21H26N2O/c1-14-9-16-12-21(2,3)23-19(18(16)10-17(14)13-22)11-20(24)15-7-5-4-6-8-15/h9-11,15,23H,4-8,12H2,1-3H3/b19-11+