ethyl (2S,3S,4E)-4-(4-chlorophenyl)-4-(4-methoxyphenyl)sulfonylimino-3-methyl-2-oxidanyl-butanoate

Systemtic Name: ethyl (2S,3S,4E)-4-(4-chlorophenyl)-4-(4-methoxyphenyl)sulfonylimino-3-methyl-2-oxidanyl-butanoate Openeye Name: ethyl (2S,3S,4E)-4-(4-chlorophenyl)-2-hydroxy-4-(4-methoxyphenyl)sulfonylimino-3-methyl-butanoate CAS Name: (2S,3S,4E)-4-(4-chlorophenyl)-2-hydroxy-4-(4-methoxyphenyl)sulfonylimino-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl (2S,3S,4E)-4-(4-chlorophenyl)-2-hydroxy-4-(4-methoxyphenyl)sulfonylimino-3-methylbutanoate Traditional Name: (2S,3S,4E)-4-(4-chlorophenyl)-2-hydroxy-4-(4-methoxyphenyl)sulfonylimino-3-methyl-butyric acid ethyl ester Formula: C20H22ClNO6S MolecularWeight: 439.90978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C(=NS(=O)(=O)C1=CC=C(C=C1)OC)C2=CC=C(C=C2)Cl)O

Isomeric SMILES

CCOC(=O)[C@H]([C@@H](C)/C(=N\S(=O)(=O)C1=CC=C(C=C1)OC)/C2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C20H22ClNO6S/c1-4-28-20(24)19(23)13(2)18(14-5-7-15(21)8-6-14)22-29(25,26)17-11-9-16(27-3)10-12-17/h5-13,19,23H,4H2,1-3H3/b22-18+/t13-,19-/m0/s1