propan-2-yl (2S)-3-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]-2-oxidanyl-propanoate

Systemtic Name: propan-2-yl (2S)-3-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]-2-oxidanyl-propanoate Openeye Name: isopropyl (2S)-2-hydroxy-3-[4-[2-(p-tolylsulfonyloxy)ethoxy]phenyl]propanoate CAS Name: (2S)-2-hydroxy-3-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-2-hydroxy-3-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]propanoate Traditional Name: (2S)-2-hydroxy-3-[4-(2-tosyloxyethoxy)phenyl]propionic acid isopropyl ester Formula: C21H26O7S MolecularWeight: 422.49194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)CC(C(=O)OC(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)C[C@@H](C(=O)OC(C)C)O

InChI

InChI=1S/C21H26O7S/c1-15(2)28-21(23)20(22)14-17-6-8-18(9-7-17)26-12-13-27-29(24,25)19-10-4-16(3)5-11-19/h4-11,15,20,22H,12-14H2,1-3H3/t20-/m0/s1