2,5-diethyl-1,4-di(phenanthren-9-yl)pyrrolo[3,4-c]pyrrole-3,6-dione

Systemtic Name: 2,5-diethyl-1,4-di(phenanthren-9-yl)pyrrolo[3,4-c]pyrrole-3,6-dione Openeye Name: 2,5-diethyl-1,4-bis(9-phenanthryl)pyrrolo[3,4-c]pyrrole-3,6-dione CAS Name: 2,5-diethyl-1,4-bis(9-phenanthrenyl)pyrrolo[3,4-c]pyrrole-3,6-dione IUPAC Name: 2,5-diethyl-1,4-di(phenanthren-9-yl)pyrrolo[3,4-c]pyrrole-3,6-dione Traditional Name: 2,5-diethyl-1,4-bis(9-phenanthryl)pyrrolo[3,4-c]pyrrole-3,6-quinone Formula: C38H28N2O2 MolecularWeight: 544.64112

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C(=C(N(C2=O)CC)C3=CC4=CC=CC=C4C5=CC=CC=C53)C1=O)C6=CC7=CC=CC=C7C8=CC=CC=C86

Isomeric SMILES

CCN1C(=C2C(=C(N(C2=O)CC)C3=CC4=CC=CC=C4C5=CC=CC=C53)C1=O)C6=CC7=CC=CC=C7C8=CC=CC=C86

InChI

InChI=1S/C38H28N2O2/c1-3-39-35(31-21-23-13-5-7-15-25(23)27-17-9-11-19-29(27)31)33-34(37(39)41)36(40(4-2)38(33)42)32-22-24-14-6-8-16-26(24)28-18-10-12-20-30(28)32/h5-22H,3-4H2,1-2H3