dihexyl 2-oxidanyl-1,3-bis(oxidanylidene)isoindole-5,6-dicarboxylate

Systemtic Name: dihexyl 2-oxidanyl-1,3-bis(oxidanylidene)isoindole-5,6-dicarboxylate Openeye Name: dihexyl 2-hydroxy-1,3-dioxo-isoindoline-5,6-dicarboxylate CAS Name: 2-hydroxy-1,3-dioxoisoindole-5,6-dicarboxylic acid dihexyl ester IUPAC Name: dihexyl 2-hydroxy-1,3-dioxoisoindole-5,6-dicarboxylate Traditional Name: 2-hydroxy-1,3-diketo-isoindoline-5,6-dicarboxylic acid dihexyl ester Formula: C22H29NO7 MolecularWeight: 419.46816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(C=C2C(=C1)C(=O)N(C2=O)O)C(=O)OCCCCCC

Isomeric SMILES

CCCCCCOC(=O)C1=C(C=C2C(=C1)C(=O)N(C2=O)O)C(=O)OCCCCCC

InChI

InChI=1S/C22H29NO7/c1-3-5-7-9-11-29-21(26)17-13-15-16(20(25)23(28)19(15)24)14-18(17)22(27)30-12-10-8-6-4-2/h13-14,28H,3-12H2,1-2H3