4-[(6,7-dimethoxyquinazolin-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(6,7-dimethoxyquinazolin-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(6,7-dimethoxyquinazolin-4-yl)methyl]benzonitrile CAS Name: 4-[(6,7-dimethoxy-4-quinazolinyl)methyl]benzonitrile IUPAC Name: 4-[(6,7-dimethoxyquinazolin-4-yl)methyl]benzonitrile Traditional Name: 4-[(6,7-dimethoxyquinazolin-4-yl)methyl]benzonitrile Formula: C18H15N3O2 MolecularWeight: 305.3306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)CC3=CC=C(C=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)CC3=CC=C(C=C3)C#N)OC

InChI

InChI=1S/C18H15N3O2/c1-22-17-8-14-15(7-12-3-5-13(10-19)6-4-12)20-11-21-16(14)9-18(17)23-2/h3-6,8-9,11H,7H2,1-2H3