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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(COCC2=CC=C(C=C2)C)O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)C[C@H](COCC2=CC=C(C=C2)C)O

InChI

InChI=1S/C17H27NO2/c1-14-5-7-16(8-6-14)12-20-13-17(19)11-18-9-3-4-15(2)10-18/h5-8,15,17,19H,3-4,9-13H2,1-2H3/p+1/t15-,17+/m0/s1