methyl (4R,5S)-4-[(R)-(2-chlorophenyl)sulfinyl]-2-methylidene-5-oxidanyl-hexanoate

Systemtic Name: methyl (4R,5S)-4-[(R)-(2-chlorophenyl)sulfinyl]-2-methylidene-5-oxidanyl-hexanoate Openeye Name: methyl (4R,5S)-4-[(R)-(2-chlorophenyl)sulfinyl]-5-hydroxy-2-methylene-hexanoate CAS Name: (4R,5S)-4-[(R)-(2-chlorophenyl)sulfinyl]-5-hydroxy-2-methylenehexanoic acid methyl ester IUPAC Name: methyl (4R,5S)-4-[(R)-(2-chlorophenyl)sulfinyl]-5-hydroxy-2-methylidenehexanoate Traditional Name: 2-[(2R,3S)-2-[(R)-(2-chlorophenyl)sulfinyl]-3-hydroxy-butyl]acrylic acid methyl ester Formula: C14H17ClO4S MolecularWeight: 316.80038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC(=C)C(=O)OC)S(=O)C1=CC=CC=C1Cl)O

Isomeric SMILES

C[C@@H]([C@@H](CC(=C)C(=O)OC)[S@@](=O)C1=CC=CC=C1Cl)O

InChI

InChI=1S/C14H17ClO4S/c1-9(14(17)19-3)8-13(10(2)16)20(18)12-7-5-4-6-11(12)15/h4-7,10,13,16H,1,8H2,2-3H3/t10-,13+,20-/m0/s1