[1-(4-chlorophenyl)-2-nitro-ethyl] nitrate

Systemtic Name: [1-(4-chlorophenyl)-2-nitro-ethyl] nitrate Openeye Name: [1-(4-chlorophenyl)-2-nitro-ethyl] nitrate CAS Name: nitric acid [1-(4-chlorophenyl)-2-nitroethyl] ester IUPAC Name: [1-(4-chlorophenyl)-2-nitroethyl] nitrate Traditional Name: nitric acid [1-(4-chlorophenyl)-2-nitro-ethyl] ester Formula: C8H7ClN2O5 MolecularWeight: 246.60458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C[N+](=O)[O-])O[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(C[N+](=O)[O-])O[N+](=O)[O-])Cl

InChI

InChI=1S/C8H7ClN2O5/c9-7-3-1-6(2-4-7)8(5-10(12)13)16-11(14)15/h1-4,8H,5H2