3-[(2-oxidanylidenequinoxalin-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(2-oxidanylidenequinoxalin-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(2-oxoquinoxalin-1-yl)methyl]benzonitrile CAS Name: 3-[(2-oxo-1-quinoxalinyl)methyl]benzonitrile IUPAC Name: 3-[(2-oxoquinoxalin-1-yl)methyl]benzonitrile Traditional Name: 3-[(2-ketoquinoxalin-1-yl)methyl]benzonitrile Formula: C16H11N3O MolecularWeight: 261.27804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=O)N2CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=O)N2CC3=CC=CC(=C3)C#N

InChI

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