[2-[[(cyanoamino)-pyridin-4-yl-methylidene]amino]-1-(4-nitrophenyl)propyl] nitrate

Systemtic Name: [2-[[(cyanoamino)-pyridin-4-yl-methylidene]amino]-1-(4-nitrophenyl)propyl] nitrate Openeye Name: [2-[[(cyanoamino)-(4-pyridyl)methylene]amino]-1-(4-nitrophenyl)propyl] nitrate CAS Name: nitric acid [2-[[(cyanoamino)-pyridin-4-ylmethylidene]amino]-1-(4-nitrophenyl)propyl] ester IUPAC Name: [2-[[(cyanoamino)-pyridin-4-ylmethylidene]amino]-1-(4-nitrophenyl)propyl] nitrate Traditional Name: nitric acid [2-[[(cyanoamino)-(4-pyridyl)methylene]amino]-1-(4-nitrophenyl)propyl] ester Formula: C16H14N6O5 MolecularWeight: 370.31956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N6O5/c1-11(20-16(19-10-17)13-6-8-18-9-7-13)15(27-22(25)26)12-2-4-14(5-3-12)21(23)24/h2-9,11,15H,1H3,(H,19,20)