2-cyclohexyl-6-[4-[2-(diphenylamino)ethyl]piperazin-1-yl]-3H-isoindol-1-one

Systemtic Name: 2-cyclohexyl-6-[4-[2-(diphenylamino)ethyl]piperazin-1-yl]-3H-isoindol-1-one Openeye Name: 2-cyclohexyl-6-[4-[2-(N-phenylanilino)ethyl]piperazin-1-yl]isoindolin-1-one CAS Name: 2-cyclohexyl-6-[4-[2-(N-phenylanilino)ethyl]-1-piperazinyl]-3H-isoindol-1-one IUPAC Name: 2-cyclohexyl-6-[4-[2-(N-phenylanilino)ethyl]piperazin-1-yl]-3H-isoindol-1-one Traditional Name: 2-cyclohexyl-6-[4-[2-(N-phenylanilino)ethyl]piperazino]isoindolin-1-one Formula: C32H38N4O MolecularWeight: 494.67032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCN(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCN(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H38N4O/c37-32-31-24-30(17-16-26(31)25-36(32)29-14-8-3-9-15-29)34-21-18-33(19-22-34)20-23-35(27-10-4-1-5-11-27)28-12-6-2-7-13-28/h1-2,4-7,10-13,16-17,24,29H,3,8-9,14-15,18-23,25H2