3-[[(2-methoxyphenyl)methylamino]methyl]-2-methyl-4-(2-methylphenyl)isoquinolin-1-one

Systemtic Name: 3-[[(2-methoxyphenyl)methylamino]methyl]-2-methyl-4-(2-methylphenyl)isoquinolin-1-one Openeye Name: 3-[[(2-methoxyphenyl)methylamino]methyl]-2-methyl-4-(o-tolyl)isoquinolin-1-one CAS Name: 3-[[(2-methoxyphenyl)methylamino]methyl]-2-methyl-4-(2-methylphenyl)-1-isoquinolinone IUPAC Name: 3-[[(2-methoxyphenyl)methylamino]methyl]-2-methyl-4-(2-methylphenyl)isoquinolin-1-one Traditional Name: 2-methyl-3-[(o-anisylamino)methyl]-4-(o-tolyl)isocarbostyril Formula: C26H26N2O2 MolecularWeight: 398.49684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(N(C(=O)C3=CC=CC=C32)C)CNCC4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=CC=C1C2=C(N(C(=O)C3=CC=CC=C32)C)CNCC4=CC=CC=C4OC

InChI

InChI=1S/C26H26N2O2/c1-18-10-4-6-12-20(18)25-21-13-7-8-14-22(21)26(29)28(2)23(25)17-27-16-19-11-5-9-15-24(19)30-3/h4-15,27H,16-17H2,1-3H3