2-(oxolan-2-ylmethyl)-4-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-(oxolan-2-ylmethyl)-4-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]isoindole-1,3-dione Openeye Name: 4-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 2-(2-oxolanylmethyl)-4-[4-[(4-phenylphenyl)methyl]-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-(oxolan-2-ylmethyl)-4-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]isoindole-1,3-dione Traditional Name: 4-[4-(4-phenylbenzyl)piperazino]-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C30H31N3O3 MolecularWeight: 481.58544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C30H31N3O3/c34-29-26-9-4-10-27(28(26)30(35)33(29)21-25-8-5-19-36-25)32-17-15-31(16-18-32)20-22-11-13-24(14-12-22)23-6-2-1-3-7-23/h1-4,6-7,9-14,25H,5,8,15-21H2