7-methyl-2-[(4-phenoxyphenyl)methyl]-5-pyridin-4-yl-3H-isoindol-1-one

Systemtic Name: 7-methyl-2-[(4-phenoxyphenyl)methyl]-5-pyridin-4-yl-3H-isoindol-1-one Openeye Name: 7-methyl-2-[(4-phenoxyphenyl)methyl]-5-(4-pyridyl)isoindolin-1-one CAS Name: 7-methyl-2-[(4-phenoxyphenyl)methyl]-5-pyridin-4-yl-3H-isoindol-1-one IUPAC Name: 7-methyl-2-[(4-phenoxyphenyl)methyl]-5-pyridin-4-yl-3H-isoindol-1-one Traditional Name: 7-methyl-2-(4-phenoxybenzyl)-5-(4-pyridyl)isoindolin-1-one Formula: C27H22N2O2 MolecularWeight: 406.47578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)N(C2)CC3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)N(C2)CC3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C27H22N2O2/c1-19-15-22(21-11-13-28-14-12-21)16-23-18-29(27(30)26(19)23)17-20-7-9-25(10-8-20)31-24-5-3-2-4-6-24/h2-16H,17-18H2,1H3