[(Z)-1-(4-nitrophenyl)-2-(1-propylimidazol-2-yl)ethenyl] 4-nitrobenzoate

Systemtic Name: [(Z)-1-(4-nitrophenyl)-2-(1-propylimidazol-2-yl)ethenyl] 4-nitrobenzoate Openeye Name: [(Z)-1-(4-nitrophenyl)-2-(1-propylimidazol-2-yl)vinyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(Z)-1-(4-nitrophenyl)-2-(1-propyl-2-imidazolyl)ethenyl] ester IUPAC Name: [(Z)-1-(4-nitrophenyl)-2-(1-propylimidazol-2-yl)ethenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(Z)-1-(4-nitrophenyl)-2-(1-propylimidazol-2-yl)vinyl] ester Formula: C21H18N4O6 MolecularWeight: 422.39082

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1C=C(C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C=CN=C1/C=C(/C2=CC=C(C=C2)[N+](=O)[O-])\OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O6/c1-2-12-23-13-11-22-20(23)14-19(15-3-7-17(8-4-15)24(27)28)31-21(26)16-5-9-18(10-6-16)25(29)30/h3-11,13-14H,2,12H2,1H3/b19-14-