2-[4-butyl-2,3-bis(oxidanylidene)quinoxalin-1-yl]ethanenitrile

Systemtic Name: 2-[4-butyl-2,3-bis(oxidanylidene)quinoxalin-1-yl]ethanenitrile Openeye Name: 2-(4-butyl-2,3-dioxo-quinoxalin-1-yl)acetonitrile CAS Name: 2-(4-butyl-2,3-dioxo-1-quinoxalinyl)acetonitrile IUPAC Name: 2-(4-butyl-2,3-dioxoquinoxalin-1-yl)acetonitrile Traditional Name: 2-(4-butyl-2,3-diketo-quinoxalin-1-yl)acetonitrile Formula: C14H15N3O2 MolecularWeight: 257.2878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N(C(=O)C1=O)CC#N

Isomeric SMILES

CCCCN1C2=CC=CC=C2N(C(=O)C1=O)CC#N

InChI

InChI=1S/C14H15N3O2/c1-2-3-9-16-11-6-4-5-7-12(11)17(10-8-15)14(19)13(16)18/h4-7H,2-3,9-10H2,1H3