2-[(3S)-3-ethyl-3-methyl-4H-isoquinolin-1-yl]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[(3S)-3-ethyl-3-methyl-4H-isoquinolin-1-yl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[(3S)-3-ethyl-3-methyl-4H-isoquinolin-1-yl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[(3S)-3-ethyl-3-methyl-4H-isoquinolin-1-yl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[(3S)-3-ethyl-3-methyl-4H-isoquinolin-1-yl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[(3S)-3-ethyl-3-methyl-4H-isoquinolin-1-yl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C20H25NO2 MolecularWeight: 311.418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@]1(CC2=CC=CC=C2C(=N1)C3C(=O)CC(CC3=O)(C)C)C

InChI

InChI=1S/C20H25NO2/c1-5-20(4)10-13-8-6-7-9-14(13)18(21-20)17-15(22)11-19(2,3)12-16(17)23/h6-9,17H,5,10-12H2,1-4H3/t20-/m0/s1