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

Systemtic Name: (2S)-1-[(4-methylphenyl)methoxy]-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol Openeye Name: (2S)-1-(4-methylpiperidin-1-ium-1-yl)-3-(p-tolylmethoxy)propan-2-ol CAS Name: (2S)-1-[(4-methylphenyl)methoxy]-3-(4-methyl-1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-[(4-methylphenyl)methoxy]-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol Traditional Name: (2S)-1-(4-methylbenzyl)oxy-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(COCC2=CC=C(C=C2)C)O

Isomeric SMILES

CC1CC[NH+](CC1)C[C@@H](COCC2=CC=C(C=C2)C)O

InChI

InChI=1S/C17H27NO2/c1-14-3-5-16(6-4-14)12-20-13-17(19)11-18-9-7-15(2)8-10-18/h3-6,15,17,19H,7-13H2,1-2H3/p+1/t17-/m0/s1