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

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 2-(4-acetamidophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 2-(4-acetamidophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-acetamidophenyl)-1,3-dioxo-5-isoindolecarboxylic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 2-(4-acetamidophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-acetamidophenyl)-1,3-diketo-isoindoline-5-carboxylic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C27H24N2O6 MolecularWeight: 472.48926

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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)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)C

InChI

InChI=1S/C27H24N2O6/c1-16-12-17(2)14-22(13-16)34-10-11-35-27(33)19-4-9-23-24(15-19)26(32)29(25(23)31)21-7-5-20(6-8-21)28-18(3)30/h4-9,12-15H,10-11H2,1-3H3,(H,28,30)