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

Systemtic Name: 4,6-diphenyl-5-(3-phenylpropoxymethyl)-3-piperidin-4-yl-isoindol-1-one Openeye Name: 4,6-diphenyl-5-(3-phenylpropoxymethyl)-3-(4-piperidyl)isoindol-1-one CAS Name: 4,6-diphenyl-5-(3-phenylpropoxymethyl)-3-(4-piperidinyl)-1-isoindolone IUPAC Name: 4,6-diphenyl-5-(3-phenylpropoxymethyl)-3-piperidin-4-ylisoindol-1-one Traditional Name: 4,6-diphenyl-5-(3-phenylpropoxymethyl)-3-(4-piperidyl)isoindol-1-one Formula: C35H34N2O2 MolecularWeight: 514.65666

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NC(=O)C3=C2C(=C(C(=C3)C4=CC=CC=C4)COCCCC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CNCCC1C2=NC(=O)C3=C2C(=C(C(=C3)C4=CC=CC=C4)COCCCC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H34N2O2/c38-35-30-23-29(26-14-6-2-7-15-26)31(24-39-22-10-13-25-11-4-1-5-12-25)32(27-16-8-3-9-17-27)33(30)34(37-35)28-18-20-36-21-19-28/h1-9,11-12,14-17,23,28,36H,10,13,18-22,24H2