4-(3-fluorophenyl)-1-[2-(3-methyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]piperidin-4-ol; methanesulfonic acid

Systemtic Name: 4-(3-fluorophenyl)-1-[2-(3-methyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]piperidin-4-ol; methanesulfonic acid Openeye Name: 4-(3-fluorophenyl)-1-[2-hydroxy-2-(4-hydroxy-3-methyl-phenyl)ethyl]piperidin-4-ol; methanesulfonic acid CAS Name: 4-(3-fluorophenyl)-1-[2-hydroxy-2-(4-hydroxy-3-methylphenyl)ethyl]-4-piperidinol; methanesulfonic acid IUPAC Name: 4-(3-fluorophenyl)-1-[2-hydroxy-2-(4-hydroxy-3-methylphenyl)ethyl]piperidin-4-ol; methanesulfonic acid Traditional Name: 4-(3-fluorophenyl)-1-[2-hydroxy-2-(4-hydroxy-3-methyl-phenyl)ethyl]piperidin-4-ol; mesylic acid Formula: C21H28FNO6S MolecularWeight: 441.513523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(CN2CCC(CC2)(C3=CC(=CC=C3)F)O)O)O.CS(=O)(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(CN2CCC(CC2)(C3=CC(=CC=C3)F)O)O)O.CS(=O)(=O)O

InChI

InChI=1S/C20H24FNO3.CH4O3S/c1-14-11-15(5-6-18(14)23)19(24)13-22-9-7-20(25,8-10-22)16-3-2-4-17(21)12-16;1-5(2,3)4/h2-6,11-12,19,23-25H,7-10,13H2,1H3;1H3,(H,2,3,4)