2-(3-methylphenoxy)ethyl 2-(4-acetamidophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 2-(3-methylphenoxy)ethyl 2-(4-acetamidophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-(3-methylphenoxy)ethyl 2-(4-acetamidophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-acetamidophenyl)-1,3-dioxo-5-isoindolecarboxylic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 2-(4-acetamidophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-acetamidophenyl)-1,3-diketo-isoindoline-5-carboxylic acid 2-(3-methylphenoxy)ethyl ester Formula: C26H22N2O6 MolecularWeight: 458.46268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCOC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCOC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C26H22N2O6/c1-16-4-3-5-21(14-16)33-12-13-34-26(32)18-6-11-22-23(15-18)25(31)28(24(22)30)20-9-7-19(8-10-20)27-17(2)29/h3-11,14-15H,12-13H2,1-2H3,(H,27,29)