[(E)-3-phenylprop-2-enyl] 4-bromanyl-3-nitro-benzoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 4-bromanyl-3-nitro-benzoate Openeye Name: [(E)-cinnamyl] 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid [(E)-cinnamyl] ester Formula: C16H12BrNO4 MolecularWeight: 362.17478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrNO4/c17-14-9-8-13(11-15(14)18(20)21)16(19)22-10-4-7-12-5-2-1-3-6-12/h1-9,11H,10H2/b7-4+