5,8-dimethyl-6-nitro-quinoline-4-carbonitrile

Systemtic Name: 5,8-dimethyl-6-nitro-quinoline-4-carbonitrile Openeye Name: 5,8-dimethyl-6-nitro-quinoline-4-carbonitrile CAS Name: 5,8-dimethyl-6-nitro-4-quinolinecarbonitrile IUPAC Name: 5,8-dimethyl-6-nitroquinoline-4-carbonitrile Traditional Name: 5,8-dimethyl-6-nitro-cinchoninonitrile Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C(C=CN=C12)C#N)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C2=C(C=CN=C12)C#N)C)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O2/c1-7-5-10(15(16)17)8(2)11-9(6-13)3-4-14-12(7)11/h3-5H,1-2H3