5-(4-oxidanylidenequinazolin-3-yl)pentanenitrile

Systemtic Name: 5-(4-oxidanylidenequinazolin-3-yl)pentanenitrile Openeye Name: 5-(4-oxoquinazolin-3-yl)pentanenitrile CAS Name: 5-(4-oxo-3-quinazolinyl)pentanenitrile IUPAC Name: 5-(4-oxoquinazolin-3-yl)pentanenitrile Traditional Name: 5-(4-ketoquinazolin-3-yl)valeronitrile Formula: C13H13N3O MolecularWeight: 227.26182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCCC#N

InChI

InChI=1S/C13H13N3O/c14-8-4-1-5-9-16-10-15-12-7-3-2-6-11(12)13(16)17/h2-3,6-7,10H,1,4-5,9H2