(1E)-1-(1,4-benzodioxin-3-ylidene)-N-(2-piperidin-1-ium-1-ylethoxy)ethanamine

Systemtic Name: (1E)-1-(1,4-benzodioxin-3-ylidene)-N-(2-piperidin-1-ium-1-ylethoxy)ethanamine Openeye Name: (1E)-1-(1,4-benzodioxin-3-ylidene)-N-(2-piperidin-1-ium-1-ylethoxy)ethanamine CAS Name: (1E)-1-(1,4-benzodioxin-3-ylidene)-N-[2-(1-piperidin-1-iumyl)ethoxy]ethanamine IUPAC Name: (1E)-1-(1,4-benzodioxin-3-ylidene)-N-(2-piperidin-1-ium-1-ylethoxy)ethanamine Traditional Name: [(1E)-1-(1,4-benzodioxin-3-ylidene)ethyl]-(2-piperidin-1-ium-1-ylethoxy)amine Formula: C17H25N2O3+ MolecularWeight: 305.392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1COC2=CC=CC=C2O1)NOCC[NH+]3CCCCC3

Isomeric SMILES

C/C(=C\1/COC2=CC=CC=C2O1)/NOCC[NH+]3CCCCC3

InChI

InChI=1S/C17H24N2O3/c1-14(18-21-12-11-19-9-5-2-6-10-19)17-13-20-15-7-3-4-8-16(15)22-17/h3-4,7-8,18H,2,5-6,9-13H2,1H3/p+1/b17-14+