[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-(2-chloranyl-6-nitro-phenoxy)benzoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-(2-chloranyl-6-nitro-phenoxy)benzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-(2-chloro-6-nitro-phenoxy)benzoate CAS Name: 4-(2-chloro-6-nitrophenoxy)benzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-(2-chloro-6-nitrophenoxy)benzoate Traditional Name: 4-(2-chloro-6-nitro-phenoxy)benzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C21H13BrClNO6 MolecularWeight: 490.68802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)OC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)OC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H13BrClNO6/c22-15-8-4-13(5-9-15)19(25)12-29-21(26)14-6-10-16(11-7-14)30-20-17(23)2-1-3-18(20)24(27)28/h1-11H,12H2