(3R)-N-(1,3-benzodioxol-5-yl)-1-[(1-ethylindol-3-yl)methyl]piperidin-1-ium-3-amine

Systemtic Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-[(1-ethylindol-3-yl)methyl]piperidin-1-ium-3-amine Openeye Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-[(1-ethylindol-3-yl)methyl]piperidin-1-ium-3-amine CAS Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-[(1-ethyl-3-indolyl)methyl]-3-piperidin-1-iumamine IUPAC Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-[(1-ethylindol-3-yl)methyl]piperidin-1-ium-3-amine Traditional Name: 1,3-benzodioxol-5-yl-[(3R)-1-[(1-ethylindol-3-yl)methyl]piperidin-1-ium-3-yl]amine Formula: C23H28N3O2+ MolecularWeight: 378.48732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C[NH+]3CCCC(C3)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C[NH+]3CCC[C@H](C3)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H27N3O2/c1-2-26-14-17(20-7-3-4-8-21(20)26)13-25-11-5-6-19(15-25)24-18-9-10-22-23(12-18)28-16-27-22/h3-4,7-10,12,14,19,24H,2,5-6,11,13,15-16H2,1H3/p+1/t19-/m1/s1