hexyl 2-(4-methoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: hexyl 2-(4-methoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: hexyl 2-(4-methoxyphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-methoxyphenyl)-1,3-dioxo-5-isoindolecarboxylic acid hexyl ester IUPAC Name: hexyl 2-(4-methoxyphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(4-methoxyphenyl)isoindoline-5-carboxylic acid hexyl ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H23NO5/c1-3-4-5-6-13-28-22(26)15-7-12-18-19(14-15)21(25)23(20(18)24)16-8-10-17(27-2)11-9-16/h7-12,14H,3-6,13H2,1-2H3