methyl 2-(2-methylphenyl)-4-(3,4,5-trimethylphenyl)-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(2-methylphenyl)-4-(3,4,5-trimethylphenyl)-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-(o-tolyl)-4-(3,4,5-trimethylphenyl)-1H-isoquinoline-3-carboxylate CAS Name: 2-(2-methylphenyl)-4-(3,4,5-trimethylphenyl)-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-methylphenyl)-4-(3,4,5-trimethylphenyl)-1H-isoquinoline-3-carboxylate Traditional Name: 2-(o-tolyl)-4-(3,4,5-trimethylphenyl)-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C27H27NO2 MolecularWeight: 397.50878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC3=CC=CC=C3C(=C2C(=O)OC)C4=CC(=C(C(=C4)C)C)C

Isomeric SMILES

CC1=CC=CC=C1N2CC3=CC=CC=C3C(=C2C(=O)OC)C4=CC(=C(C(=C4)C)C)C

InChI

InChI=1S/C27H27NO2/c1-17-10-6-9-13-24(17)28-16-21-11-7-8-12-23(21)25(26(28)27(29)30-5)22-14-18(2)20(4)19(3)15-22/h6-15H,16H2,1-5H3