pentyl 1,3-bis(oxidanylidene)-2-(4-pentoxycarbonylphenyl)isoindole-5-carboxylate

Systemtic Name: pentyl 1,3-bis(oxidanylidene)-2-(4-pentoxycarbonylphenyl)isoindole-5-carboxylate Openeye Name: pentyl 1,3-dioxo-2-(4-pentoxycarbonylphenyl)isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-[4-[oxo(pentoxy)methyl]phenyl]-5-isoindolecarboxylic acid pentyl ester IUPAC Name: pentyl 1,3-dioxo-2-(4-pentoxycarbonylphenyl)isoindole-5-carboxylate Traditional Name: 2-(4-amoxycarbonylphenyl)-1,3-diketo-isoindoline-5-carboxylic acid amyl ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCCCCC

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCCCCC

InChI

InChI=1S/C26H29NO6/c1-3-5-7-15-32-25(30)18-9-12-20(13-10-18)27-23(28)21-14-11-19(17-22(21)24(27)29)26(31)33-16-8-6-4-2/h9-14,17H,3-8,15-16H2,1-2H3