ditert-butyl 3,6-bis(oxidanylidene)-1,4-diphenyl-pyrrolo[3,4-c]pyrrole-2,5-dicarboxylate

Systemtic Name: ditert-butyl 3,6-bis(oxidanylidene)-1,4-diphenyl-pyrrolo[3,4-c]pyrrole-2,5-dicarboxylate Openeye Name: ditert-butyl 3,6-dioxo-1,4-diphenyl-pyrrolo[3,4-c]pyrrole-2,5-dicarboxylate CAS Name: 3,6-dioxo-1,4-diphenylpyrrolo[3,4-c]pyrrole-2,5-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 3,6-dioxo-1,4-diphenylpyrrolo[3,4-c]pyrrole-2,5-dicarboxylate Traditional Name: 3,6-diketo-1,4-diphenyl-pyrrolo[3,4-c]pyrrole-2,5-dicarboxylic acid ditert-butyl ester Formula: C28H28N2O6 MolecularWeight: 488.53172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=C2C(=C(N(C2=O)C(=O)OC(C)(C)C)C3=CC=CC=C3)C1=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=C2C(=C(N(C2=O)C(=O)OC(C)(C)C)C3=CC=CC=C3)C1=O)C4=CC=CC=C4

InChI

InChI=1S/C28H28N2O6/c1-27(2,3)35-25(33)29-21(17-13-9-7-10-14-17)19-20(23(29)31)22(18-15-11-8-12-16-18)30(24(19)32)26(34)36-28(4,5)6/h7-16H,1-6H3