(3S)-1-(2,3-dihydro-1H-inden-2-yl)-N-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-(2,3-dihydro-1H-inden-2-yl)-N-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-3-amine Openeye Name: (3S)-1-indan-2-yl-N-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-3-amine CAS Name: (3S)-1-(2,3-dihydro-1H-inden-2-yl)-N-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]-3-piperidin-1-iumamine IUPAC Name: (3S)-1-(2,3-dihydro-1H-inden-2-yl)-N-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-3-amine Traditional Name: [(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]amine Formula: C25H36N4+2 MolecularWeight: 392.58014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CC3=CC=CC=C3C2)NC4CC[NH+](CC4)CC5=CN=CC=C5

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CC3=CC=CC=C3C2)NC4CC[NH+](CC4)CC5=CN=CC=C5

InChI

InChI=1S/C25H34N4/c1-2-7-22-16-25(15-21(22)6-1)29-12-4-8-24(19-29)27-23-9-13-28(14-10-23)18-20-5-3-11-26-17-20/h1-3,5-7,11,17,23-25,27H,4,8-10,12-16,18-19H2/p+2/t24-/m0/s1