[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 3-(dimethylamino)benzoate

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 3-(dimethylamino)benzoate Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl 3-(dimethylamino)benzoate CAS Name: 3-(dimethylamino)benzoic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl 3-(dimethylamino)benzoate Traditional Name: 3-(dimethylamino)benzoic acid [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=O)N2CC#N

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=O)N2CC#N

InChI

InChI=1S/C20H18N4O3/c1-23(2)15-7-5-6-14(12-15)20(26)27-13-18-22-17-9-4-3-8-16(17)19(25)24(18)11-10-21/h3-9,12H,11,13H2,1-2H3