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

Systemtic Name: (2R)-1-(4-chloranyl-3-methyl-phenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-(4-chloro-3-methyl-phenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(4-chloro-3-methylphenoxy)-3-[(2S)-2-methyl-1-piperidin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(4-chloro-3-methylphenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-(4-chloro-3-methyl-phenoxy)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propan-2-ol Formula: C16H25ClNO2+ MolecularWeight: 298.8282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24ClNO2/c1-12-9-15(6-7-16(12)17)20-11-14(19)10-18-8-4-3-5-13(18)2/h6-7,9,13-14,19H,3-5,8,10-11H2,1-2H3/p+1/t13-,14+/m0/s1