dimethyl-[2-[3-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]propanoylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[3-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]propanoylamino]ethyl]azanium Openeye Name: dimethyl-[2-[3-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]propanoylamino]ethyl]ammonium CAS Name: dimethyl-[2-[[1-oxo-3-[1-(pyridin-4-ylmethyl)-4-piperidin-1-iumyl]propyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[3-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]propanoylamino]ethyl]azanium Traditional Name: dimethyl-[2-[3-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]propanoylamino]ethyl]ammonium Formula: C18H32N4O+2 MolecularWeight: 320.47288

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)CCC1CC[NH+](CC1)CC2=CC=NC=C2

Isomeric SMILES

C[NH+](C)CCNC(=O)CCC1CC[NH+](CC1)CC2=CC=NC=C2

InChI

InChI=1S/C18H30N4O/c1-21(2)14-11-20-18(23)4-3-16-7-12-22(13-8-16)15-17-5-9-19-10-6-17/h5-6,9-10,16H,3-4,7-8,11-15H2,1-2H3,(H,20,23)/p+2