[(E)-3-chloranyl-2-(4-nitrophenyl)carbonyloxy-prop-2-enyl] 4-nitrobenzoate

Systemtic Name: [(E)-3-chloranyl-2-(4-nitrophenyl)carbonyloxy-prop-2-enyl] 4-nitrobenzoate Openeye Name: [(E)-3-chloro-2-(4-nitrobenzoyl)oxy-allyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(E)-3-chloro-2-[(4-nitrophenyl)-oxomethoxy]prop-2-enyl] ester IUPAC Name: [(E)-3-chloro-2-(4-nitrobenzoyl)oxyprop-2-enyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(E)-3-chloro-2-(4-nitrobenzoyl)oxy-allyl] ester Formula: C17H11ClN2O8 MolecularWeight: 406.73084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(=CCl)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC/C(=C\Cl)/OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H11ClN2O8/c18-9-15(28-17(22)12-3-7-14(8-4-12)20(25)26)10-27-16(21)11-1-5-13(6-2-11)19(23)24/h1-9H,10H2/b15-9+