[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 3-(2-chloranyl-6-nitro-phenoxy)benzoate

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 3-(2-chloranyl-6-nitro-phenoxy)benzoate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] 3-(2-chloro-6-nitro-phenoxy)benzoate CAS Name: 3-(2-chloro-6-nitrophenoxy)benzoic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] 3-(2-chloro-6-nitrophenoxy)benzoate Traditional Name: 3-(2-chloro-6-nitro-phenoxy)benzoic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C21H13Cl2NO6 MolecularWeight: 446.23702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=CC=C2Cl)[N+](=O)[O-])C(=O)OCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=CC=C2Cl)[N+](=O)[O-])C(=O)OCC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H13Cl2NO6/c22-15-9-7-13(8-10-15)19(25)12-29-21(26)14-3-1-4-16(11-14)30-20-17(23)5-2-6-18(20)24(27)28/h1-11H,12H2