[4-(4-fluorophenyl)-1-methyl-piperidin-3-yl]methanol; 4-methylbenzenesulfonic acid

Systemtic Name: [4-(4-fluorophenyl)-1-methyl-piperidin-3-yl]methanol; 4-methylbenzenesulfonic acid Openeye Name: [4-(4-fluorophenyl)-1-methyl-3-piperidyl]methanol; 4-methylbenzenesulfonic acid CAS Name: [4-(4-fluorophenyl)-1-methyl-3-piperidinyl]methanol; 4-methylbenzenesulfonic acid IUPAC Name: [4-(4-fluorophenyl)-1-methylpiperidin-3-yl]methanol; 4-methylbenzenesulfonic acid Traditional Name: [4-(4-fluorophenyl)-1-methyl-3-piperidyl]methanol; tosylic acid Formula: C20H26FNO4S MolecularWeight: 395.488143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CN1CCC(C(C1)CO)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CN1CCC(C(C1)CO)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H18FNO.C7H8O3S/c1-15-7-6-13(11(8-15)9-16)10-2-4-12(14)5-3-10;1-6-2-4-7(5-3-6)11(8,9)10/h2-5,11,13,16H,6-9H2,1H3;2-5H,1H3,(H,8,9,10)