2-[6-[4-(diphenylmethyl)piperazin-1-yl]-6-oxidanylidene-hexyl]isoindole-1,3-dione

Systemtic Name: 2-[6-[4-(diphenylmethyl)piperazin-1-yl]-6-oxidanylidene-hexyl]isoindole-1,3-dione Openeye Name: 2-[6-(4-benzhydrylpiperazin-1-yl)-6-oxo-hexyl]isoindoline-1,3-dione CAS Name: 2-[6-[4-(diphenylmethyl)-1-piperazinyl]-6-oxohexyl]isoindole-1,3-dione IUPAC Name: 2-[6-(4-benzhydrylpiperazin-1-yl)-6-oxohexyl]isoindole-1,3-dione Traditional Name: 2-[6-(4-benzhydrylpiperazino)-6-keto-hexyl]isoindoline-1,3-quinone Formula: C31H33N3O3 MolecularWeight: 495.61202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCCCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCCCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C31H33N3O3/c35-28(18-8-3-11-19-34-30(36)26-16-9-10-17-27(26)31(34)37)32-20-22-33(23-21-32)29(24-12-4-1-5-13-24)25-14-6-2-7-15-25/h1-2,4-7,9-10,12-17,29H,3,8,11,18-23H2