5,5-dimethyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)cyclohexane-1,3-quinone Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CC(N=C2C3C(=O)CC(CC3=O)(C)C)(C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CC(N=C2C3C(=O)CC(CC3=O)(C)C)(C)C)C

InChI

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