4-methyl-7-(oxan-4-yloxymethyl)-2,3-bis(phenylmethyl)-4,7-dihydro-3H-isoindol-1-one

Systemtic Name: 4-methyl-7-(oxan-4-yloxymethyl)-2,3-bis(phenylmethyl)-4,7-dihydro-3H-isoindol-1-one Openeye Name: 2,3-dibenzyl-4-methyl-7-(tetrahydropyran-4-yloxymethyl)-4,7-dihydro-3H-isoindol-1-one CAS Name: 4-methyl-7-(4-oxanyloxymethyl)-2,3-bis(phenylmethyl)-4,7-dihydro-3H-isoindol-1-one IUPAC Name: 2,3-dibenzyl-4-methyl-7-(oxan-4-yloxymethyl)-4,7-dihydro-3H-isoindol-1-one Traditional Name: 2,3-dibenzyl-4-methyl-7-(tetrahydropyran-4-yloxymethyl)-4,7-dihydro-3H-isoindol-1-one Formula: C29H33NO3 MolecularWeight: 443.57722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(C2=C1C(N(C2=O)CC3=CC=CC=C3)CC4=CC=CC=C4)COC5CCOCC5

Isomeric SMILES

CC1C=CC(C2=C1C(N(C2=O)CC3=CC=CC=C3)CC4=CC=CC=C4)COC5CCOCC5

InChI

InChI=1S/C29H33NO3/c1-21-12-13-24(20-33-25-14-16-32-17-15-25)28-27(21)26(18-22-8-4-2-5-9-22)30(29(28)31)19-23-10-6-3-7-11-23/h2-13,21,24-26H,14-20H2,1H3