2-(3,3-diethyl-2,4-dihydroisoquinolin-1-ylidene)-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-(3,3-diethyl-2,4-dihydroisoquinolin-1-ylidene)-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(3,3-diethyl-2,4-dihydroisoquinolin-1-ylidene)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(3,3-diethyl-2,4-dihydroisoquinolin-1-ylidene)-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(3,3-diethyl-2,4-dihydroisoquinolin-1-ylidene)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(3,3-diethyl-2,4-dihydroisoquinolin-1-ylidene)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C(=C3C(=O)CC(CC3=O)(C)C)N1)CC

Isomeric SMILES

CCC1(CC2=CC=CC=C2C(=C3C(=O)CC(CC3=O)(C)C)N1)CC

InChI

InChI=1S/C21H27NO2/c1-5-21(6-2)11-14-9-7-8-10-15(14)19(22-21)18-16(23)12-20(3,4)13-17(18)24/h7-10,22H,5-6,11-13H2,1-4H3