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

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 4-(dimethylamino)benzoate Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl 4-(dimethylamino)benzoate CAS Name: 4-(dimethylamino)benzoic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl 4-(dimethylamino)benzoate Traditional Name: 4-(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=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3C(=O)N2CC#N

Isomeric SMILES

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

InChI

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