(2S)-1-(1,3-benzodioxol-5-yloxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-(1,3-benzodioxol-5-yloxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-(1,3-benzodioxol-5-yloxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-(1,3-benzodioxol-5-yloxy)-3-(1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-(1,3-benzodioxol-5-yloxy)-3-pyrrolidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-(1,3-benzodioxol-5-yloxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol Formula: C14H20NO4+ MolecularWeight: 266.3129

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(COC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

C1CC[NH+](C1)C[C@@H](COC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C14H19NO4/c16-11(8-15-5-1-2-6-15)9-17-12-3-4-13-14(7-12)19-10-18-13/h3-4,7,11,16H,1-2,5-6,8-10H2/p+1/t11-/m0/s1