[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[2,4,5-tris(chloranyl)phenoxy]ethanoate

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[2,4,5-tris(chloranyl)phenoxy]ethanoate Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl] 2-(2,4,5-trichlorophenoxy)acetate CAS Name: 2-(2,4,5-trichlorophenoxy)acetic acid [2-(4-chloro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxoethyl] 2-(2,4,5-trichlorophenoxy)acetate Traditional Name: 2-(2,4,5-trichlorophenoxy)acetic acid [2-(4-chloro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C16H10Cl4N2O6 MolecularWeight: 468.0724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)COC(=O)COC2=CC(=C(C=C2Cl)Cl)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)COC(=O)COC2=CC(=C(C=C2Cl)Cl)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H10Cl4N2O6/c17-9-2-1-8(3-13(9)22(25)26)21-15(23)6-28-16(24)7-27-14-5-11(19)10(18)4-12(14)20/h1-5H,6-7H2,(H,21,23)