[(E)-1-nitro-1,4-diphenyl-but-3-en-2-yl] nitrate

Systemtic Name: [(E)-1-nitro-1,4-diphenyl-but-3-en-2-yl] nitrate Openeye Name: [(E)-1-[nitro(phenyl)methyl]-3-phenyl-allyl] nitrate CAS Name: nitric acid [(E)-1-nitro-1,4-diphenylbut-3-en-2-yl] ester IUPAC Name: [(E)-1-nitro-1,4-diphenylbut-3-en-2-yl] nitrate Traditional Name: nitric acid [(E)-1-[nitro(phenyl)methyl]-3-phenyl-allyl] ester Formula: C16H14N2O5 MolecularWeight: 314.29276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O5/c19-17(20)16(14-9-5-2-6-10-14)15(23-18(21)22)12-11-13-7-3-1-4-8-13/h1-12,15-16H/b12-11+