1,4-bis(3,5-ditert-butylphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione

Systemtic Name: 1,4-bis(3,5-ditert-butylphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione Openeye Name: 1,4-bis(3,5-ditert-butylphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione CAS Name: 1,4-bis(3,5-ditert-butylphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione IUPAC Name: 1,4-bis(3,5-ditert-butylphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione Traditional Name: 1,4-bis(3,5-ditert-butylphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-quinone Formula: C34H44N2O2 MolecularWeight: 512.72536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=C3C(=C(NC3=O)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)C(=O)N2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=C3C(=C(NC3=O)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)C(=O)N2)C(C)(C)C

InChI

InChI=1S/C34H44N2O2/c1-31(2,3)21-13-19(14-22(17-21)32(4,5)6)27-25-26(30(38)35-27)28(36-29(25)37)20-15-23(33(7,8)9)18-24(16-20)34(10,11)12/h13-18H,1-12H3,(H,35,38)(H,36,37)