[(E)-3-chloranylprop-2-enyl] 4-nitrobenzoate

Systemtic Name: [(E)-3-chloranylprop-2-enyl] 4-nitrobenzoate Openeye Name: [(E)-3-chloroallyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(E)-3-chloroprop-2-enyl] ester IUPAC Name: [(E)-3-chloroprop-2-enyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(E)-3-chloroallyl] ester Formula: C10H8ClNO4 MolecularWeight: 241.62782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC=CCl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C10H8ClNO4/c11-6-1-7-16-10(13)8-2-4-9(5-3-8)12(14)15/h1-6H,7H2/b6-1+