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

Systemtic Name: [(E)-3-phenylprop-2-enyl] 4-(dimethylamino)-3-nitro-benzoate Openeye Name: [(E)-cinnamyl] 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-nitro-benzoic acid [(E)-cinnamyl] ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)OCC=CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O4/c1-19(2)16-11-10-15(13-17(16)20(22)23)18(21)24-12-6-9-14-7-4-3-5-8-14/h3-11,13H,12H2,1-2H3/b9-6+