(4-tert-butyl-2,6-dimethyl-phenyl)methyl 3-(phenylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 3-(phenylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 3-benzylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate CAS Name: 3-(phenylmethylene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 3-benzylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Traditional Name: 3-benzal-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C33H33NO2 MolecularWeight: 475.62062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2=C3CCC(=CC4=CC=CC=C4)C3=NC5=CC=CC=C52)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2=C3CCC(=CC4=CC=CC=C4)C3=NC5=CC=CC=C52)C)C(C)(C)C

InChI

InChI=1S/C33H33NO2/c1-21-17-25(33(3,4)5)18-22(2)28(21)20-36-32(35)30-26-13-9-10-14-29(26)34-31-24(15-16-27(30)31)19-23-11-7-6-8-12-23/h6-14,17-19H,15-16,20H2,1-5H3