4-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]benzonitrile CAS Name: 4-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]benzonitrile IUPAC Name: 4-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]benzonitrile Traditional Name: 4-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]benzonitrile Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O3/c1-23-15-8-13-14(9-16(15)24-2)20-17(21-18(13)22)7-11-3-5-12(10-19)6-4-11/h3-6,8-9H,7H2,1-2H3,(H,20,21,22)