3,5,8-triphenoxy-10-phenylazanyl-3a,5a-dihydropyrene-1,6-dione

Systemtic Name: 3,5,8-triphenoxy-10-phenylazanyl-3a,5a-dihydropyrene-1,6-dione Openeye Name: 10-anilino-3,5,8-triphenoxy-3a,5a-dihydropyrene-1,6-dione CAS Name: 10-anilino-3,5,8-triphenoxy-3a,5a-dihydropyrene-1,6-dione IUPAC Name: 10-anilino-3,5,8-triphenoxy-3a,5a-dihydropyrene-1,6-dione Traditional Name: 10-anilino-3,5,8-triphenoxy-3a,5a-dihydropyrene-1,6-quinone Formula: C40H27NO5 MolecularWeight: 601.64608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C3C(=O)C=C(C4C3=C5C(C(=C4)OC6=CC=CC=C6)C(=O)C=C(C5=C2)OC7=CC=CC=C7)OC8=CC=CC=C8

Isomeric SMILES

C1=CC=C(C=C1)NC2=C3C(=O)C=C(C4C3=C5C(C(=C4)OC6=CC=CC=C6)C(=O)C=C(C5=C2)OC7=CC=CC=C7)OC8=CC=CC=C8

InChI

InChI=1S/C40H27NO5/c42-32-23-35(45-27-17-9-3-10-18-27)30-22-36(46-28-19-11-4-12-20-28)40-33(43)24-34(44-26-15-7-2-8-16-26)29-21-31(39(32)37(30)38(29)40)41-25-13-5-1-6-14-25/h1-24,30,40-41H