2-[4-[4-[2-(diphenylmethyl)oxyethyl]piperazin-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-[2-(diphenylmethyl)oxyethyl]piperazin-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(2-benzhydryloxyethyl)piperazin-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-[2-(diphenylmethyl)oxyethyl]-1-piperazinyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(2-benzhydryloxyethyl)piperazin-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(2-benzhydryloxyethyl)piperazino]butyl]isoindoline-1,3-quinone Formula: C31H35N3O3 MolecularWeight: 497.6279

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3C2=O)CCOC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3C2=O)CCOC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H35N3O3/c35-30-27-15-7-8-16-28(27)31(36)34(30)18-10-9-17-32-19-21-33(22-20-32)23-24-37-29(25-11-3-1-4-12-25)26-13-5-2-6-14-26/h1-8,11-16,29H,9-10,17-24H2