8-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-4H-1,3-benzodioxin-6-amine

Systemtic Name: 8-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-4H-1,3-benzodioxin-6-amine Openeye Name: 8-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-4H-1,3-benzodioxin-6-amine CAS Name: 8-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-4H-1,3-benzodioxin-6-amine IUPAC Name: 8-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-4H-1,3-benzodioxin-6-amine Traditional Name: [8-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-4H-1,3-benzodioxin-6-yl]amine Formula: C15H23N2O2+ MolecularWeight: 263.35532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C3C(=CC(=C2)N)COCO3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=C3C(=CC(=C2)N)COCO3

InChI

InChI=1S/C15H22N2O2/c1-11-3-2-4-17(7-11)8-12-5-14(16)6-13-9-18-10-19-15(12)13/h5-6,11H,2-4,7-10,16H2,1H3/p+1/t11-/m0/s1