(2-methoxy-5-nitro-phenyl) 4-chloranyl-3-nitro-benzoate

Systemtic Name: (2-methoxy-5-nitro-phenyl) 4-chloranyl-3-nitro-benzoate Openeye Name: (2-methoxy-5-nitro-phenyl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (2-methoxy-5-nitrophenyl) ester IUPAC Name: (2-methoxy-5-nitrophenyl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (2-methoxy-5-nitro-phenyl) ester Formula: C14H9ClN2O7 MolecularWeight: 352.68346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H9ClN2O7/c1-23-12-5-3-9(16(19)20)7-13(12)24-14(18)8-2-4-10(15)11(6-8)17(21)22/h2-7H,1H3