3-(2,6-dimethyl-3,5-dinitro-1,4-dihydropyridin-4-yl)benzenecarbonitrile

Systemtic Name: 3-(2,6-dimethyl-3,5-dinitro-1,4-dihydropyridin-4-yl)benzenecarbonitrile Openeye Name: 3-(2,6-dimethyl-3,5-dinitro-1,4-dihydropyridin-4-yl)benzonitrile CAS Name: 3-(2,6-dimethyl-3,5-dinitro-1,4-dihydropyridin-4-yl)benzonitrile IUPAC Name: 3-(2,6-dimethyl-3,5-dinitro-1,4-dihydropyridin-4-yl)benzonitrile Traditional Name: 3-(2,6-dimethyl-3,5-dinitro-1,4-dihydropyridin-4-yl)benzonitrile Formula: C14H12N4O4 MolecularWeight: 300.26948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC(=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC(=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O4/c1-8-13(17(19)20)12(14(18(21)22)9(2)16-8)11-5-3-4-10(6-11)7-15/h3-6,12,16H,1-2H3