[2,3,4,5,6-pentakis(chloranyl)phenyl] 4-nitrobenzoate

Systemtic Name: [2,3,4,5,6-pentakis(chloranyl)phenyl] 4-nitrobenzoate Openeye Name: (2,3,4,5,6-pentachlorophenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2,3,4,5,6-pentachlorophenyl) ester IUPAC Name: (2,3,4,5,6-pentachlorophenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2,3,4,5,6-pentachlorophenyl) ester Formula: C13H4Cl5NO4 MolecularWeight: 415.44016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H4Cl5NO4/c14-7-8(15)10(17)12(11(18)9(7)16)23-13(20)5-1-3-6(4-2-5)19(21)22/h1-4H