2-methyl-3-[2-(2-phenylmethoxyphenyl)ethyl]-3-piperidin-4-yl-isoindol-1-one

Systemtic Name: 2-methyl-3-[2-(2-phenylmethoxyphenyl)ethyl]-3-piperidin-4-yl-isoindol-1-one Openeye Name: 3-[2-(2-benzyloxyphenyl)ethyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one CAS Name: 2-methyl-3-[2-(2-phenylmethoxyphenyl)ethyl]-3-(4-piperidinyl)-1-isoindolone IUPAC Name: 2-methyl-3-[2-(2-phenylmethoxyphenyl)ethyl]-3-piperidin-4-ylisoindol-1-one Traditional Name: 3-[2-(2-benzoxyphenyl)ethyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one Formula: C29H32N2O2 MolecularWeight: 440.57658

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C1(CCC3=CC=CC=C3OCC4=CC=CC=C4)C5CCNCC5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C1(CCC3=CC=CC=C3OCC4=CC=CC=C4)C5CCNCC5

InChI

InChI=1S/C29H32N2O2/c1-31-28(32)25-12-6-7-13-26(25)29(31,24-16-19-30-20-17-24)18-15-23-11-5-8-14-27(23)33-21-22-9-3-2-4-10-22/h2-14,24,30H,15-21H2,1H3