[3-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)phenyl]methyl nitrate

Systemtic Name: [3-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)phenyl]methyl nitrate Openeye Name: [3-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)phenyl]methyl nitrate CAS Name: nitric acid [3-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)phenyl]methyl ester IUPAC Name: [3-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)phenyl]methyl nitrate Traditional Name: nitric acid [3-(3,5-dicyano-2,6-dimethyl-1,4-dihydropyridin-4-yl)benzyl] ester Formula: C16H14N4O3 MolecularWeight: 310.30736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O3/c1-10-14(7-17)16(15(8-18)11(2)19-10)13-5-3-4-12(6-13)9-23-20(21)22/h3-6,16,19H,9H2,1-2H3