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

Systemtic Name: 2-[2-[[2,4-bis(chloranyl)-5-prop-2-ynoxy-phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-(2,4-dichloro-5-prop-2-ynoxy-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2,4-dichloro-5-prop-2-ynoxyanilino)-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-(2,4-dichloro-5-prop-2-ynoxyanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2,4-dichloro-5-propargyloxy-anilino)-2-keto-ethyl]thio]acetate Formula: C13H10Cl2NO4S- MolecularWeight: 347.1938

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=C(C(=C1)NC(=O)CSCC(=O)[O-])Cl)Cl

Isomeric SMILES

C#CCOC1=C(C=C(C(=C1)NC(=O)CSCC(=O)[O-])Cl)Cl

InChI

InChI=1S/C13H11Cl2NO4S/c1-2-3-20-11-5-10(8(14)4-9(11)15)16-12(17)6-21-7-13(18)19/h1,4-5H,3,6-7H2,(H,16,17)(H,18,19)/p-1