(2S)-1-(4-chloranyl-3-methyl-phenoxy)-3-piperidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-(4-chloranyl-3-methyl-phenoxy)-3-piperidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-(4-chloro-3-methyl-phenoxy)-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-(4-chloro-3-methylphenoxy)-3-(1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-(4-chloro-3-methylphenoxy)-3-piperidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-(4-chloro-3-methyl-phenoxy)-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C15H23ClNO2+ MolecularWeight: 284.80162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(C[NH+]2CCCCC2)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC[C@H](C[NH+]2CCCCC2)O)Cl

InChI

InChI=1S/C15H22ClNO2/c1-12-9-14(5-6-15(12)16)19-11-13(18)10-17-7-3-2-4-8-17/h5-6,9,13,18H,2-4,7-8,10-11H2,1H3/p+1/t13-/m0/s1