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

Systemtic Name: 2-(3,3,5-trimethyl-2,4-dihydroisoquinolin-1-ylidene)cyclohexane-1,3-dione Openeye Name: 2-(3,3,5-trimethyl-2,4-dihydroisoquinolin-1-ylidene)cyclohexane-1,3-dione CAS Name: 2-(3,3,5-trimethyl-2,4-dihydroisoquinolin-1-ylidene)cyclohexane-1,3-dione IUPAC Name: 2-(3,3,5-trimethyl-2,4-dihydroisoquinolin-1-ylidene)cyclohexane-1,3-dione Traditional Name: 2-(3,3,5-trimethyl-2,4-dihydroisoquinolin-1-ylidene)cyclohexane-1,3-quinone Formula: C18H21NO2 MolecularWeight: 283.36484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1CC(NC2=C3C(=O)CCCC3=O)(C)C

Isomeric SMILES

CC1=CC=CC2=C1CC(NC2=C3C(=O)CCCC3=O)(C)C

InChI

InChI=1S/C18H21NO2/c1-11-6-4-7-12-13(11)10-18(2,3)19-17(12)16-14(20)8-5-9-15(16)21/h4,6-7,19H,5,8-10H2,1-3H3