[1-[(2-chloranyl-4-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3-chloranylphenoxy)propanoate

Systemtic Name: [1-[(2-chloranyl-4-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3-chloranylphenoxy)propanoate Openeye Name: [2-(2-chloro-4-nitro-anilino)-1-methyl-2-oxo-ethyl] 2-(3-chlorophenoxy)propanoate CAS Name: 2-(3-chlorophenoxy)propanoic acid [1-(2-chloro-4-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-chloro-4-nitroanilino)-1-oxopropan-2-yl] 2-(3-chlorophenoxy)propanoate Traditional Name: 2-(3-chlorophenoxy)propionic acid [2-(2-chloro-4-nitro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C18H16Cl2N2O6 MolecularWeight: 427.23544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)OC(=O)C(C)OC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)OC(=O)C(C)OC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H16Cl2N2O6/c1-10(17(23)21-16-7-6-13(22(25)26)9-15(16)20)28-18(24)11(2)27-14-5-3-4-12(19)8-14/h3-11H,1-2H3,(H,21,23)