(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-piperidin-1-ium-1-yl-ethanamine

Systemtic Name: (1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-piperidin-1-ium-1-yl-ethanamine Openeye Name: (1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-piperidin-1-ium-1-yl-ethanamine CAS Name: (1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-piperidin-1-iumyl)ethanamine IUPAC Name: (1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-piperidin-1-ium-1-ylethanamine Traditional Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-piperidin-1-ium-1-yl-ethyl]amine Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(C2=CC3=C(C=C2)OCCO3)N

Isomeric SMILES

C1CC[NH+](CC1)C[C@H](C2=CC3=C(C=C2)OCCO3)N

InChI

InChI=1S/C15H22N2O2/c16-13(11-17-6-2-1-3-7-17)12-4-5-14-15(10-12)19-9-8-18-14/h4-5,10,13H,1-3,6-9,11,16H2/p+1/t13-/m1/s1