1,4,6,8,10-pentakis-phenylisoindolo[5,6-g]phthalazine-7,9-dione

Systemtic Name: 1,4,6,8,10-pentakis-phenylisoindolo[5,6-g]phthalazine-7,9-dione Openeye Name: 1,4,6,8,10-pentakis-phenylisoindolo[5,6-g]phthalazine-7,9-dione CAS Name: 1,4,6,8,10-pentakis-phenylisoindolo[5,6-g]phthalazine-7,9-dione IUPAC Name: 1,4,6,8,10-pentakis-phenylisoindolo[5,6-g]phthalazine-7,9-dione Traditional Name: 1,4,6,8,10-pentakis-phenylisoindolo[5,6-g]phthalazine-7,9-quinone Formula: C44H27N3O2 MolecularWeight: 629.70408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=C(C4=CC5=C(C=C42)C(=NN=C5C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8)C(=O)N(C3=O)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=C(C4=CC5=C(C=C42)C(=NN=C5C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8)C(=O)N(C3=O)C9=CC=CC=C9

InChI

InChI=1S/C44H27N3O2/c48-43-39-37(28-16-6-1-7-17-28)33-26-35-36(42(31-22-12-4-13-23-31)46-45-41(35)30-20-10-3-11-21-30)27-34(33)38(29-18-8-2-9-19-29)40(39)44(49)47(43)32-24-14-5-15-25-32/h1-27H