[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]ethanoate

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]ethanoate Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl 2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]acetate CAS Name: 2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]acetic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetate Traditional Name: 2-(2,2-dimethylcoumaran-7-yl)oxyacetic acid [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C23H21N3O5 MolecularWeight: 419.42994

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC#N)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC#N)C

InChI

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