4-(1,3-benzodioxol-5-yl)-1-prop-2-ynyl-piperidin-1-ium-4-ol

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-1-prop-2-ynyl-piperidin-1-ium-4-ol Openeye Name: 4-(1,3-benzodioxol-5-yl)-1-prop-2-ynyl-piperidin-1-ium-4-ol CAS Name: 4-(1,3-benzodioxol-5-yl)-1-prop-2-ynyl-4-piperidin-1-iumol IUPAC Name: 4-(1,3-benzodioxol-5-yl)-1-prop-2-ynylpiperidin-1-ium-4-ol Traditional Name: 4-(1,3-benzodioxol-5-yl)-1-propargyl-piperidin-1-ium-4-ol Formula: C15H18NO3+ MolecularWeight: 260.30832

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Descriptors Computed from Structure

Canonical SMILES:

C#CC[NH+]1CCC(CC1)(C2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

C#CC[NH+]1CCC(CC1)(C2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C15H17NO3/c1-2-7-16-8-5-15(17,6-9-16)12-3-4-13-14(10-12)19-11-18-13/h1,3-4,10,17H,5-9,11H2/p+1