(1S)-1-(1,3-benzodioxol-5-yl)-3-piperidin-1-ium-1-yl-propan-1-ol

Systemtic Name: (1S)-1-(1,3-benzodioxol-5-yl)-3-piperidin-1-ium-1-yl-propan-1-ol Openeye Name: (1S)-1-(1,3-benzodioxol-5-yl)-3-piperidin-1-ium-1-yl-propan-1-ol CAS Name: (1S)-1-(1,3-benzodioxol-5-yl)-3-(1-piperidin-1-iumyl)-1-propanol IUPAC Name: (1S)-1-(1,3-benzodioxol-5-yl)-3-piperidin-1-ium-1-ylpropan-1-ol Traditional Name: (1S)-1-(1,3-benzodioxol-5-yl)-3-piperidin-1-ium-1-yl-propan-1-ol Formula: C15H22NO3+ MolecularWeight: 264.34008

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC(C2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

C1CC[NH+](CC1)CC[C@@H](C2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C15H21NO3/c17-13(6-9-16-7-2-1-3-8-16)12-4-5-14-15(10-12)19-11-18-14/h4-5,10,13,17H,1-3,6-9,11H2/p+1/t13-/m0/s1