(2R)-1-(3-ethylphenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2R)-1-(3-ethylphenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-(3-ethylphenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(3-ethylphenoxy)-3-[(3R)-3-methyl-1-piperidin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(3-ethylphenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-(3-ethylphenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCC(C[NH+]2CCCC(C2)C)O

Isomeric SMILES

CCC1=CC(=CC=C1)OC[C@@H](C[NH+]2CCC[C@H](C2)C)O

InChI

InChI=1S/C17H27NO2/c1-3-15-7-4-8-17(10-15)20-13-16(19)12-18-9-5-6-14(2)11-18/h4,7-8,10,14,16,19H,3,5-6,9,11-13H2,1-2H3/p+1/t14-,16-/m1/s1