2-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[2-(4-benzhydrylpiperazino)-2-keto-ethyl]benzo[de]isoquinoline-1,3-quinone Formula: C31H27N3O3 MolecularWeight: 489.56438

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

InChI

InChI=1S/C31H27N3O3/c35-27(21-34-30(36)25-15-7-13-22-14-8-16-26(28(22)25)31(34)37)32-17-19-33(20-18-32)29(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-16,29H,17-21H2