(2S)-2-[2-(2-chloranyl-4-methylsulfonyl-phenyl)-6-methyl-pyridin-3-yl]oxypropanoic acid

Systemtic Name: (2S)-2-[2-(2-chloranyl-4-methylsulfonyl-phenyl)-6-methyl-pyridin-3-yl]oxypropanoic acid Openeye Name: (2S)-2-[[2-(2-chloro-4-methylsulfonyl-phenyl)-6-methyl-3-pyridyl]oxy]propanoic acid CAS Name: (2S)-2-[[2-(2-chloro-4-methylsulfonylphenyl)-6-methyl-3-pyridinyl]oxy]propanoic acid IUPAC Name: (2S)-2-[2-(2-chloro-4-methylsulfonylphenyl)-6-methylpyridin-3-yl]oxypropanoic acid Traditional Name: (2S)-2-[[2-(2-chloro-4-mesyl-phenyl)-6-methyl-3-pyridyl]oxy]propionic acid Formula: C16H16ClNO5S MolecularWeight: 369.81994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OC(C)C(=O)O)C2=C(C=C(C=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=NC(=C(C=C1)O[C@@H](C)C(=O)O)C2=C(C=C(C=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C16H16ClNO5S/c1-9-4-7-14(23-10(2)16(19)20)15(18-9)12-6-5-11(8-13(12)17)24(3,21)22/h4-8,10H,1-3H3,(H,19,20)/t10-/m0/s1