[(E)-3-phenylprop-2-enyl] 3-nitrobenzoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 3-nitrobenzoate Openeye Name: [(E)-cinnamyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [(E)-cinnamyl] ester Formula: C16H13NO4 MolecularWeight: 283.27872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO4/c18-16(14-9-4-10-15(12-14)17(19)20)21-11-5-8-13-6-2-1-3-7-13/h1-10,12H,11H2/b8-5+