(2S)-1-[(4-chlorophenyl)methoxy]-3-[(2R)-2-methylpiperidin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2S)-1-[(4-chlorophenyl)methoxy]-3-[(2R)-2-methylpiperidin-1-ium-1-yl]propan-2-ol Openeye Name: (2S)-1-[(4-chlorophenyl)methoxy]-3-[(2R)-2-methylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2S)-1-[(4-chlorophenyl)methoxy]-3-[(2R)-2-methyl-1-piperidin-1-iumyl]-2-propanol IUPAC Name: (2S)-1-[(4-chlorophenyl)methoxy]-3-[(2R)-2-methylpiperidin-1-ium-1-yl]propan-2-ol Traditional Name: (2S)-1-(4-chlorobenzyl)oxy-3-[(2R)-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(COCC2=CC=C(C=C2)Cl)O

Isomeric SMILES

C[C@@H]1CCCC[NH+]1C[C@@H](COCC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C16H24ClNO2/c1-13-4-2-3-9-18(13)10-16(19)12-20-11-14-5-7-15(17)8-6-14/h5-8,13,16,19H,2-4,9-12H2,1H3/p+1/t13-,16+/m1/s1