6-nitro-6-(3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl)hexanenitrile

Systemtic Name: 6-nitro-6-(3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl)hexanenitrile Openeye Name: 6-nitro-6-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)hexanenitrile CAS Name: 6-nitro-6-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)hexanenitrile IUPAC Name: 6-nitro-6-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)hexanenitrile Traditional Name: 6-(3-keto-2,4-dihydro-1H-quinoxalin-2-yl)-6-nitro-hexanenitrile Formula: C14H16N4O3 MolecularWeight: 288.30184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(C(=O)N2)C(CCCCC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(C(=O)N2)C(CCCCC#N)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O3/c15-9-5-1-2-8-12(18(20)21)13-14(19)17-11-7-4-3-6-10(11)16-13/h3-4,6-7,12-13,16H,1-2,5,8H2,(H,17,19)