2-[4-(4-oxidanylidene-1H-quinazolin-6-yl)phenyl]ethanenitrile

Systemtic Name: 2-[4-(4-oxidanylidene-1H-quinazolin-6-yl)phenyl]ethanenitrile Openeye Name: 2-[4-(4-oxo-1H-quinazolin-6-yl)phenyl]acetonitrile CAS Name: 2-[4-(4-oxo-1H-quinazolin-6-yl)phenyl]acetonitrile IUPAC Name: 2-[4-(4-oxo-1H-quinazolin-6-yl)phenyl]acetonitrile Traditional Name: 2-[4-(4-keto-1H-quinazolin-6-yl)phenyl]acetonitrile Formula: C16H11N3O MolecularWeight: 261.27804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)C2=CC3=C(C=C2)NC=NC3=O

Isomeric SMILES

C1=CC(=CC=C1CC#N)C2=CC3=C(C=C2)NC=NC3=O

InChI

InChI=1S/C16H11N3O/c17-8-7-11-1-3-12(4-2-11)13-5-6-15-14(9-13)16(20)19-10-18-15/h1-6,9-10H,7H2,(H,18,19,20)