4,6-diphenyl-5-(phenylmethoxymethyl)-3-piperidin-4-yl-isoindol-1-one

Systemtic Name: 4,6-diphenyl-5-(phenylmethoxymethyl)-3-piperidin-4-yl-isoindol-1-one Openeye Name: 5-(benzyloxymethyl)-4,6-diphenyl-3-(4-piperidyl)isoindol-1-one CAS Name: 4,6-diphenyl-5-(phenylmethoxymethyl)-3-(4-piperidinyl)-1-isoindolone IUPAC Name: 4,6-diphenyl-5-(phenylmethoxymethyl)-3-piperidin-4-ylisoindol-1-one Traditional Name: 5-(benzoxymethyl)-4,6-diphenyl-3-(4-piperidyl)isoindol-1-one Formula: C33H30N2O2 MolecularWeight: 486.6035

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NC(=O)C3=C2C(=C(C(=C3)C4=CC=CC=C4)COCC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CNCCC1C2=NC(=O)C3=C2C(=C(C(=C3)C4=CC=CC=C4)COCC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H30N2O2/c36-33-28-20-27(24-12-6-2-7-13-24)29(22-37-21-23-10-4-1-5-11-23)30(25-14-8-3-9-15-25)31(28)32(35-33)26-16-18-34-19-17-26/h1-15,20,26,34H,16-19,21-22H2