3-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)pentanenitrile

Systemtic Name: 3-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)pentanenitrile Openeye Name: 3-(3-oxo-2,4-dihydroquinoxalin-1-yl)pentanenitrile CAS Name: 3-(3-oxo-2,4-dihydroquinoxalin-1-yl)pentanenitrile IUPAC Name: 3-(3-oxo-2,4-dihydroquinoxalin-1-yl)pentanenitrile Traditional Name: 3-(3-keto-2,4-dihydroquinoxalin-1-yl)valeronitrile Formula: C13H15N3O MolecularWeight: 229.2777

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)N1CC(=O)NC2=CC=CC=C21

Isomeric SMILES

CCC(CC#N)N1CC(=O)NC2=CC=CC=C21

InChI

InChI=1S/C13H15N3O/c1-2-10(7-8-14)16-9-13(17)15-11-5-3-4-6-12(11)16/h3-6,10H,2,7,9H2,1H3,(H,15,17)