6-[3-[4-(3-phenylphenyl)piperazin-1-yl]propoxy]-2,3-dihydroisoindol-1-one

Systemtic Name: 6-[3-[4-(3-phenylphenyl)piperazin-1-yl]propoxy]-2,3-dihydroisoindol-1-one Openeye Name: 6-[3-[4-(3-phenylphenyl)piperazin-1-yl]propoxy]isoindolin-1-one CAS Name: 6-[3-[4-(3-phenylphenyl)-1-piperazinyl]propoxy]-2,3-dihydroisoindol-1-one IUPAC Name: 6-[3-[4-(3-phenylphenyl)piperazin-1-yl]propoxy]-2,3-dihydroisoindol-1-one Traditional Name: 6-[3-[4-(3-phenylphenyl)piperazino]propoxy]isoindolin-1-one Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC3=C(CNC3=O)C=C2)C4=CC=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCOC2=CC3=C(CNC3=O)C=C2)C4=CC=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H29N3O2/c31-27-26-19-25(11-10-23(26)20-28-27)32-17-5-12-29-13-15-30(16-14-29)24-9-4-8-22(18-24)21-6-2-1-3-7-21/h1-4,6-11,18-19H,5,12-17,20H2,(H,28,31)