N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-methyl-piperidin-1-ium-4-amine

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-methyl-piperidin-1-ium-4-amine Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-methyl-piperidin-1-ium-4-amine CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-methyl-4-piperidin-1-iumamine IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-methylpiperidin-1-ium-4-amine Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-(1-methylpiperidin-1-ium-4-yl)amine Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

C[NH+]1CCC(CC1)NC[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C15H22N2O2/c1-17-8-6-12(7-9-17)16-10-13-11-18-14-4-2-3-5-15(14)19-13/h2-5,12-13,16H,6-11H2,1H3/p+1/t13-/m0/s1