2-[12-[1,3-bis(oxidanylidene)isoindol-2-yl]dodeca-5,7-diynyl]isoindole-1,3-dione

Systemtic Name: 2-[12-[1,3-bis(oxidanylidene)isoindol-2-yl]dodeca-5,7-diynyl]isoindole-1,3-dione Openeye Name: 2-[12-(1,3-dioxoisoindolin-2-yl)dodeca-5,7-diynyl]isoindoline-1,3-dione CAS Name: 2-[12-(1,3-dioxo-2-isoindolyl)dodeca-5,7-diynyl]isoindole-1,3-dione IUPAC Name: 2-[12-(1,3-dioxoisoindol-2-yl)dodeca-5,7-diynyl]isoindole-1,3-dione Traditional Name: 2-(12-phthalimidododeca-5,7-diynyl)isoindoline-1,3-quinone Formula: C28H24N2O4 MolecularWeight: 452.50116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCC#CC#CCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCC#CC#CCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C28H24N2O4/c31-25-21-15-9-10-16-22(21)26(32)29(25)19-13-7-5-3-1-2-4-6-8-14-20-30-27(33)23-17-11-12-18-24(23)28(30)34/h9-12,15-18H,5-8,13-14,19-20H2