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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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