phenyl 2-(4-butoxycarbonylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: phenyl 2-(4-butoxycarbonylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: phenyl 2-(4-butoxycarbonylphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-[4-[butoxy(oxo)methyl]phenyl]-1,3-dioxo-5-isoindolecarboxylic acid phenyl ester IUPAC Name: phenyl 2-(4-butoxycarbonylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-butoxycarbonylphenyl)-1,3-diketo-isoindoline-5-carboxylic acid phenyl ester Formula: C26H21NO6 MolecularWeight: 443.44804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC=CC=C4

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C26H21NO6/c1-2-3-15-32-25(30)17-9-12-19(13-10-17)27-23(28)21-14-11-18(16-22(21)24(27)29)26(31)33-20-7-5-4-6-8-20/h4-14,16H,2-3,15H2,1H3