(2R)-1-(1,3-benzodioxol-5-ylmethoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2R)-1-(1,3-benzodioxol-5-ylmethoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-(1,3-benzodioxol-5-ylmethoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(1,3-benzodioxol-5-ylmethoxy)-3-[(3R)-3-methyl-1-piperidin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(1,3-benzodioxol-5-ylmethoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-[(3R)-3-methylpiperidin-1-ium-1-yl]-3-piperonyloxy-propan-2-ol Formula: C17H26NO4+ MolecularWeight: 308.39264

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(COCC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)C[C@H](COCC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C17H25NO4/c1-13-3-2-6-18(8-13)9-15(19)11-20-10-14-4-5-16-17(7-14)22-12-21-16/h4-5,7,13,15,19H,2-3,6,8-12H2,1H3/p+1/t13-,15-/m1/s1