2-[2-[[2,4-bis(chloranyl)-5-propan-2-yloxy-phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[[2,4-bis(chloranyl)-5-propan-2-yloxy-phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-(2,4-dichloro-5-isopropoxy-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2,4-dichloro-5-propan-2-yloxyanilino)-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-(2,4-dichloro-5-propan-2-yloxyanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2,4-dichloro-5-isopropoxy-anilino)-2-keto-ethyl]thio]acetate Formula: C13H14Cl2NO4S- MolecularWeight: 351.22556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C(=C1)NC(=O)CSCC(=O)[O-])Cl)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C(=C1)NC(=O)CSCC(=O)[O-])Cl)Cl

InChI

InChI=1S/C13H15Cl2NO4S/c1-7(2)20-11-4-10(8(14)3-9(11)15)16-12(17)5-21-6-13(18)19/h3-4,7H,5-6H2,1-2H3,(H,16,17)(H,18,19)/p-1