N-[3-(1,3-benzodioxol-5-yloxy)propyl]pyridin-1-ium-2-amine

Systemtic Name: N-[3-(1,3-benzodioxol-5-yloxy)propyl]pyridin-1-ium-2-amine Openeye Name: N-[3-(1,3-benzodioxol-5-yloxy)propyl]pyridin-1-ium-2-amine CAS Name: N-[3-(1,3-benzodioxol-5-yloxy)propyl]-2-pyridin-1-iumamine IUPAC Name: N-[3-(1,3-benzodioxol-5-yloxy)propyl]pyridin-1-ium-2-amine Traditional Name: 3-(1,3-benzodioxol-5-yloxy)propyl-pyridin-1-ium-2-yl-amine Formula: C15H17N2O3+ MolecularWeight: 273.30708

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCCCNC3=CC=CC=[NH+]3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCCCNC3=CC=CC=[NH+]3

InChI

InChI=1S/C15H16N2O3/c1-2-7-16-15(4-1)17-8-3-9-18-12-5-6-13-14(10-12)20-11-19-13/h1-2,4-7,10H,3,8-9,11H2,(H,16,17)/p+1