[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate Openeye Name: [2-(2-allylsulfanylanilino)-2-oxo-ethyl] 2-(4-chloro-3-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-3-methylphenoxy)acetic acid [2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl] 2-(4-chloro-3-methylphenoxy)acetate Traditional Name: 2-(4-chloro-3-methyl-phenoxy)acetic acid [2-[2-(allylthio)anilino]-2-keto-ethyl] ester Formula: C20H20ClNO4S MolecularWeight: 405.8951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OCC(=O)NC2=CC=CC=C2SCC=C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OCC(=O)NC2=CC=CC=C2SCC=C)Cl

InChI

InChI=1S/C20H20ClNO4S/c1-3-10-27-18-7-5-4-6-17(18)22-19(23)12-26-20(24)13-25-15-8-9-16(21)14(2)11-15/h3-9,11H,1,10,12-13H2,2H3,(H,22,23)