2-[2-butoxy-5-[(2S,5S)-5-(3,4,5-trimethoxyphenyl)oxan-2-yl]phenyl]sulfonylethanol

Systemtic Name: 2-[2-butoxy-5-[(2S,5S)-5-(3,4,5-trimethoxyphenyl)oxan-2-yl]phenyl]sulfonylethanol Openeye Name: 2-[2-butoxy-5-[(2S,5S)-5-(3,4,5-trimethoxyphenyl)tetrahydropyran-2-yl]phenyl]sulfonylethanol CAS Name: 2-[2-butoxy-5-[(2S,5S)-5-(3,4,5-trimethoxyphenyl)-2-oxanyl]phenyl]sulfonylethanol IUPAC Name: 2-[2-butoxy-5-[(2S,5S)-5-(3,4,5-trimethoxyphenyl)oxan-2-yl]phenyl]sulfonylethanol Traditional Name: 2-[2-butoxy-5-[(2S,5S)-5-(3,4,5-trimethoxyphenyl)tetrahydropyran-2-yl]phenyl]sulfonylethanol Formula: C26H36O8S MolecularWeight: 508.62424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2CCC(CO2)C3=CC(=C(C(=C3)OC)OC)OC)S(=O)(=O)CCO

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)[C@@H]2CC[C@H](CO2)C3=CC(=C(C(=C3)OC)OC)OC)S(=O)(=O)CCO

InChI

InChI=1S/C26H36O8S/c1-5-6-12-33-22-10-7-18(16-25(22)35(28,29)13-11-27)21-9-8-19(17-34-21)20-14-23(30-2)26(32-4)24(15-20)31-3/h7,10,14-16,19,21,27H,5-6,8-9,11-13,17H2,1-4H3/t19-,21+/m1/s1