[6-ethyl-4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 2-(4-acetamidophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: [6-ethyl-4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 2-(4-acetamidophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [6-ethyl-4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 2-(4-acetamidophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-acetamidophenyl)-1,3-dioxo-5-isoindolecarboxylic acid [6-ethyl-4-oxo-3-(4-phenylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [6-ethyl-4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 2-(4-acetamidophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-acetamidophenyl)-1,3-diketo-isoindoline-5-carboxylic acid [6-ethyl-4-keto-3-(4-phenylphenoxy)chromen-7-yl] ester Formula: C40H28N2O8 MolecularWeight: 664.65892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)OC3=CC=C(C=C3)C4=CC=CC=C4)OC(=O)C5=CC6=C(C=C5)C(=O)N(C6=O)C7=CC=C(C=C7)NC(=O)C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)OC3=CC=C(C=C3)C4=CC=CC=C4)OC(=O)C5=CC6=C(C=C5)C(=O)N(C6=O)C7=CC=C(C=C7)NC(=O)C

InChI

InChI=1S/C40H28N2O8/c1-3-24-19-33-35(48-22-36(37(33)44)49-30-16-9-26(10-17-30)25-7-5-4-6-8-25)21-34(24)50-40(47)27-11-18-31-32(20-27)39(46)42(38(31)45)29-14-12-28(13-15-29)41-23(2)43/h4-22H,3H2,1-2H3,(H,41,43)