(3-nitrophenyl) 2-chloranyl-4-nitro-benzoate

Systemtic Name: (3-nitrophenyl) 2-chloranyl-4-nitro-benzoate Openeye Name: (3-nitrophenyl) 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (3-nitrophenyl) ester Formula: C13H7ClN2O6 MolecularWeight: 322.65748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7ClN2O6/c14-12-7-9(16(20)21)4-5-11(12)13(17)22-10-3-1-2-8(6-10)15(18)19/h1-7H