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

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-chloranylbenzoate Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C18H12ClN3O3 MolecularWeight: 353.75918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)COC(=O)C3=CC=CC=C3Cl)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)COC(=O)C3=CC=CC=C3Cl)CC#N

InChI

InChI=1S/C18H12ClN3O3/c19-14-7-3-1-5-12(14)18(24)25-11-16-21-15-8-4-2-6-13(15)17(23)22(16)10-9-20/h1-8H,10-11H2