(4-ethanoylphenyl) 3-(2-chloranyl-4-nitro-phenoxy)benzoate

Systemtic Name: (4-ethanoylphenyl) 3-(2-chloranyl-4-nitro-phenoxy)benzoate Openeye Name: (4-acetylphenyl) 3-(2-chloro-4-nitro-phenoxy)benzoate CAS Name: 3-(2-chloro-4-nitrophenoxy)benzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 3-(2-chloro-4-nitrophenoxy)benzoate Traditional Name: 3-(2-chloro-4-nitro-phenoxy)benzoic acid (4-acetylphenyl) ester Formula: C21H14ClNO6 MolecularWeight: 411.79196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H14ClNO6/c1-13(24)14-5-8-17(9-6-14)29-21(25)15-3-2-4-18(11-15)28-20-10-7-16(23(26)27)12-19(20)22/h2-12H,1H3