1-(4-methylphenyl)-4-(4-nonadecoxyphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione

Systemtic Name: 1-(4-methylphenyl)-4-(4-nonadecoxyphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione Openeye Name: 4-(4-nonadecoxyphenyl)-1-(p-tolyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione CAS Name: 1-(4-methylphenyl)-4-(4-nonadecoxyphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione IUPAC Name: 1-(4-methylphenyl)-4-(4-nonadecoxyphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione Traditional Name: 4-(4-nonadecoxyphenyl)-1-(p-tolyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-quinone Formula: C38H52N2O3 MolecularWeight: 584.83108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C3C(=C(NC3=O)C4=CC=C(C=C4)C)C(=O)N2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C3C(=C(NC3=O)C4=CC=C(C=C4)C)C(=O)N2

InChI

InChI=1S/C38H52N2O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-28-43-32-26-24-31(25-27-32)36-34-33(37(41)40-36)35(39-38(34)42)30-22-20-29(2)21-23-30/h20-27H,3-19,28H2,1-2H3,(H,39,42)(H,40,41)