1,4-bis(3-ethyl-2-oxidanylidene-1-phenyl-benzimidazol-5-yl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione

Systemtic Name: 1,4-bis(3-ethyl-2-oxidanylidene-1-phenyl-benzimidazol-5-yl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione Openeye Name: 1,4-bis(3-ethyl-2-oxo-1-phenyl-benzimidazol-5-yl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione CAS Name: 1,4-bis(3-ethyl-2-oxo-1-phenyl-5-benzimidazolyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione IUPAC Name: 1,4-bis(3-ethyl-2-oxo-1-phenylbenzimidazol-5-yl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione Traditional Name: 1,4-bis(3-ethyl-2-keto-1-phenyl-benzimidazol-5-yl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-quinone Formula: C36H28N6O4 MolecularWeight: 608.64532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C3=C4C(=C(NC4=O)C5=CC6=C(C=C5)N(C(=O)N6CC)C7=CC=CC=C7)C(=O)N3)N(C1=O)C8=CC=CC=C8

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C3=C4C(=C(NC4=O)C5=CC6=C(C=C5)N(C(=O)N6CC)C7=CC=CC=C7)C(=O)N3)N(C1=O)C8=CC=CC=C8

InChI

InChI=1S/C36H28N6O4/c1-3-39-27-19-21(15-17-25(27)41(35(39)45)23-11-7-5-8-12-23)31-29-30(34(44)37-31)32(38-33(29)43)22-16-18-26-28(20-22)40(4-2)36(46)42(26)24-13-9-6-10-14-24/h5-20H,3-4H2,1-2H3,(H,37,44)(H,38,43)