[2-[(2-chloranyl-5-methylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxypropanoate

Systemtic Name: [2-[(2-chloranyl-5-methylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxypropanoate Openeye Name: [2-(2-chloro-5-methylsulfonyl-anilino)-2-oxo-ethyl] (2R)-2-phenoxypropanoate CAS Name: (2R)-2-phenoxypropanoic acid [2-(2-chloro-5-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-5-methylsulfonylanilino)-2-oxoethyl] (2R)-2-phenoxypropanoate Traditional Name: (2R)-2-phenoxypropionic acid [2-(2-chloro-5-mesyl-anilino)-2-keto-ethyl] ester Formula: C18H18ClNO6S MolecularWeight: 411.85662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)C)Cl)OC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)C)Cl)OC2=CC=CC=C2

InChI

InChI=1S/C18H18ClNO6S/c1-12(26-13-6-4-3-5-7-13)18(22)25-11-17(21)20-16-10-14(27(2,23)24)8-9-15(16)19/h3-10,12H,11H2,1-2H3,(H,20,21)/t12-/m1/s1