2,6-bis[4-(2-methylpiperidin-1-yl)but-2-ynyl]pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone

Systemtic Name: 2,6-bis[4-(2-methylpiperidin-1-yl)but-2-ynyl]pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone Openeye Name: 2,6-bis[4-(2-methyl-1-piperidyl)but-2-ynyl]pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone CAS Name: 2,6-bis[4-(2-methyl-1-piperidinyl)but-2-ynyl]pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone IUPAC Name: 2,6-bis[4-(2-methylpiperidin-1-yl)but-2-ynyl]pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone Traditional Name: 2,6-bis[4-(2-methylpiperidino)but-2-ynyl]pyrrol[3,4-f]isoindole-1,3,5,7-diquinone Formula: C30H34N4O4 MolecularWeight: 514.61536

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC#CCN2C(=O)C3=CC4=C(C=C3C2=O)C(=O)N(C4=O)CC#CCN5CCCCC5C

Isomeric SMILES

CC1CCCCN1CC#CCN2C(=O)C3=CC4=C(C=C3C2=O)C(=O)N(C4=O)CC#CCN5CCCCC5C

InChI

InChI=1S/C30H34N4O4/c1-21-11-3-5-13-31(21)15-7-9-17-33-27(35)23-19-25-26(20-24(23)28(33)36)30(38)34(29(25)37)18-10-8-16-32-14-6-4-12-22(32)2/h19-22H,3-6,11-18H2,1-2H3