1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 2-(4-ethoxyphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-ethoxyphenyl)-1,3-dioxo-5-isoindolecarboxylic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 2-(4-ethoxyphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-p-phenetyl-isoindoline-5-carboxylic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C27H21N3O6 MolecularWeight: 483.47214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC(C)C4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC(C)C4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C27H21N3O6/c1-3-35-18-11-9-17(10-12-18)30-25(32)19-13-8-16(14-21(19)26(30)33)27(34)36-15(2)23-28-22-7-5-4-6-20(22)24(31)29-23/h4-15H,3H2,1-2H3,(H,28,29,31)