3,8-diphenoxy-5,10-bis(phenylazanyl)pyrene-1,6-dione

Systemtic Name: 3,8-diphenoxy-5,10-bis(phenylazanyl)pyrene-1,6-dione Openeye Name: 5,10-dianilino-3,8-diphenoxy-pyrene-1,6-dione CAS Name: 5,10-dianilino-3,8-diphenoxypyrene-1,6-dione IUPAC Name: 5,10-dianilino-3,8-diphenoxypyrene-1,6-dione Traditional Name: 5,10-dianilino-3,8-diphenoxy-pyrene-1,6-quinone Formula: C40H26N2O4 MolecularWeight: 598.64544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C3C(=O)C=C(C4=CC(=C5C(=O)C=C(C(=C2)C5=C43)OC6=CC=CC=C6)NC7=CC=CC=C7)OC8=CC=CC=C8

Isomeric SMILES

C1=CC=C(C=C1)NC2=C3C(=O)C=C(C4=CC(=C5C(=O)C=C(C(=C2)C5=C43)OC6=CC=CC=C6)NC7=CC=CC=C7)OC8=CC=CC=C8

InChI

InChI=1S/C40H26N2O4/c43-33-23-36(46-28-19-11-4-12-20-28)30-22-32(42-26-15-7-2-8-16-26)40-34(44)24-35(45-27-17-9-3-10-18-27)29-21-31(39(33)37(30)38(29)40)41-25-13-5-1-6-14-25/h1-24,41-42H