(2R)-1-(4-chloranyl-3,5-dimethyl-phenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2R)-1-(4-chloranyl-3,5-dimethyl-phenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-(4-chloro-3,5-dimethyl-phenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(4-chloro-3,5-dimethylphenoxy)-3-[(2S)-2-methyl-1-piperidin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(4-chloro-3,5-dimethylphenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-(4-chloro-3,5-dimethyl-phenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol Formula: C17H27ClNO2+ MolecularWeight: 312.85478

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(COC2=CC(=C(C(=C2)C)Cl)C)O

Isomeric SMILES

C[C@H]1CCCC[NH+]1C[C@H](COC2=CC(=C(C(=C2)C)Cl)C)O

InChI

InChI=1S/C17H26ClNO2/c1-12-8-16(9-13(2)17(12)18)21-11-15(20)10-19-7-5-4-6-14(19)3/h8-9,14-15,20H,4-7,10-11H2,1-3H3/p+1/t14-,15+/m0/s1