2-[4-methoxy-3-[2-(4-methylpiperidin-1-yl)ethoxy]phenyl]-7-(trichloromethyl)-3H-isoindol-1-one

Systemtic Name: 2-[4-methoxy-3-[2-(4-methylpiperidin-1-yl)ethoxy]phenyl]-7-(trichloromethyl)-3H-isoindol-1-one Openeye Name: 2-[4-methoxy-3-[2-(4-methyl-1-piperidyl)ethoxy]phenyl]-7-(trichloromethyl)isoindolin-1-one CAS Name: 2-[4-methoxy-3-[2-(4-methyl-1-piperidinyl)ethoxy]phenyl]-7-(trichloromethyl)-3H-isoindol-1-one IUPAC Name: 2-[4-methoxy-3-[2-(4-methylpiperidin-1-yl)ethoxy]phenyl]-7-(trichloromethyl)-3H-isoindol-1-one Traditional Name: 2-[4-methoxy-3-[2-(4-methylpiperidino)ethoxy]phenyl]-7-(trichloromethyl)isoindolin-1-one Formula: C24H27Cl3N2O3 MolecularWeight: 497.84178

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CCOC2=C(C=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)C(Cl)(Cl)Cl)OC

Isomeric SMILES

CC1CCN(CC1)CCOC2=C(C=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)C(Cl)(Cl)Cl)OC

InChI

InChI=1S/C24H27Cl3N2O3/c1-16-8-10-28(11-9-16)12-13-32-21-14-18(6-7-20(21)31-2)29-15-17-4-3-5-19(24(25,26)27)22(17)23(29)30/h3-7,14,16H,8-13,15H2,1-2H3