[2,4,6-tris(chloranyl)phenyl] 2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoate

Systemtic Name: [2,4,6-tris(chloranyl)phenyl] 2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoate Openeye Name: (2,4,6-trichlorophenyl) 2-(4-carbamoyl-2-nitro-phenyl)sulfanylacetate CAS Name: 2-[(4-carbamoyl-2-nitrophenyl)thio]acetic acid (2,4,6-trichlorophenyl) ester IUPAC Name: (2,4,6-trichlorophenyl) 2-(4-carbamoyl-2-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-carbamoyl-2-nitro-phenyl)thio]acetic acid (2,4,6-trichlorophenyl) ester Formula: C15H9Cl3N2O5S MolecularWeight: 435.66636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9Cl3N2O5S/c16-8-4-9(17)14(10(18)5-8)25-13(21)6-26-12-2-1-7(15(19)22)3-11(12)20(23)24/h1-5H,6H2,(H2,19,22)