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

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-isopentyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(3-methylbutyl)-1,3-dioxo-5-isoindolecarboxylic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-(3-methylbutyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-isoamyl-1,3-diketo-isoindoline-5-carboxylic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C23H21N3O5 MolecularWeight: 419.42994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H21N3O5/c1-13(2)9-10-26-21(28)15-8-7-14(11-17(15)22(26)29)23(30)31-12-19-24-18-6-4-3-5-16(18)20(27)25-19/h3-8,11,13H,9-10,12H2,1-2H3,(H,24,25,27)