1-[2-(3-fluoranyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]-4-(6-methoxypyridin-3-yl)piperidin-4-ol; methanesulfonic acid

Systemtic Name: 1-[2-(3-fluoranyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]-4-(6-methoxypyridin-3-yl)piperidin-4-ol; methanesulfonic acid Openeye Name: 1-[2-(3-fluoro-4-hydroxy-phenyl)-2-hydroxy-ethyl]-4-(6-methoxy-3-pyridyl)piperidin-4-ol; methanesulfonic acid CAS Name: 1-[2-(3-fluoro-4-hydroxyphenyl)-2-hydroxyethyl]-4-(6-methoxy-3-pyridinyl)-4-piperidinol; methanesulfonic acid IUPAC Name: 1-[2-(3-fluoro-4-hydroxyphenyl)-2-hydroxyethyl]-4-(6-methoxypyridin-3-yl)piperidin-4-ol; methanesulfonic acid Traditional Name: 1-[2-(3-fluoro-4-hydroxy-phenyl)-2-hydroxy-ethyl]-4-(6-methoxy-3-pyridyl)piperidin-4-ol; mesylic acid Formula: C20H27FN2O7S MolecularWeight: 458.500983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C2(CCN(CC2)CC(C3=CC(=C(C=C3)O)F)O)O.CS(=O)(=O)O

Isomeric SMILES

COC1=NC=C(C=C1)C2(CCN(CC2)CC(C3=CC(=C(C=C3)O)F)O)O.CS(=O)(=O)O

InChI

InChI=1S/C19H23FN2O4.CH4O3S/c1-26-18-5-3-14(11-21-18)19(25)6-8-22(9-7-19)12-17(24)13-2-4-16(23)15(20)10-13;1-5(2,3)4/h2-5,10-11,17,23-25H,6-9,12H2,1H3;1H3,(H,2,3,4)