(3-cyanophenyl)methyl 2-(4-oxidanylidenequinazolin-3-yl)ethanoate

Systemtic Name: (3-cyanophenyl)methyl 2-(4-oxidanylidenequinazolin-3-yl)ethanoate Openeye Name: (3-cyanophenyl)methyl 2-(4-oxoquinazolin-3-yl)acetate CAS Name: 2-(4-oxo-3-quinazolinyl)acetic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 2-(4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(4-ketoquinazolin-3-yl)acetic acid (3-cyanobenzyl) ester Formula: C18H13N3O3 MolecularWeight: 319.31412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)OCC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)OCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H13N3O3/c19-9-13-4-3-5-14(8-13)11-24-17(22)10-21-12-20-16-7-2-1-6-15(16)18(21)23/h1-8,12H,10-11H2