3-[methyl-(5-nitroquinolin-6-yl)amino]propanenitrile

Systemtic Name: 3-[methyl-(5-nitroquinolin-6-yl)amino]propanenitrile Openeye Name: 3-[methyl-(5-nitro-6-quinolyl)amino]propanenitrile CAS Name: 3-[methyl-(5-nitro-6-quinolinyl)amino]propanenitrile IUPAC Name: 3-[methyl-(5-nitroquinolin-6-yl)amino]propanenitrile Traditional Name: 3-[methyl-(5-nitro-6-quinolyl)amino]propionitrile Formula: C13H12N4O2 MolecularWeight: 256.25998

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=C(C2=C(C=C1)N=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CCC#N)C1=C(C2=C(C=C1)N=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O2/c1-16(9-3-7-14)12-6-5-11-10(4-2-8-15-11)13(12)17(18)19/h2,4-6,8H,3,9H2,1H3