2-[(7-chloranyl-4-oxidanylidene-quinazolin-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(7-chloranyl-4-oxidanylidene-quinazolin-3-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(7-chloro-4-oxo-quinazolin-3-yl)methyl]benzonitrile CAS Name: 2-[(7-chloro-4-oxo-3-quinazolinyl)methyl]benzonitrile IUPAC Name: 2-[(7-chloro-4-oxoquinazolin-3-yl)methyl]benzonitrile Traditional Name: 2-[(7-chloro-4-keto-quinazolin-3-yl)methyl]benzonitrile Formula: C16H10ClN3O MolecularWeight: 295.7231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=NC3=C(C2=O)C=CC(=C3)Cl)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=NC3=C(C2=O)C=CC(=C3)Cl)C#N

InChI

InChI=1S/C16H10ClN3O/c17-13-5-6-14-15(7-13)19-10-20(16(14)21)9-12-4-2-1-3-11(12)8-18/h1-7,10H,9H2