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

Systemtic Name: dimethyl-[2-[3-[1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-yl]propanoylamino]ethyl]azanium Openeye Name: 2-[3-[1-(isoxazol-3-ylmethyl)piperidin-1-ium-4-yl]propanoylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[3-[1-(3-isoxazolylmethyl)-4-piperidin-1-iumyl]-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: dimethyl-[2-[3-[1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-yl]propanoylamino]ethyl]azanium Traditional Name: 2-[3-[1-(isoxazol-3-ylmethyl)piperidin-1-ium-4-yl]propanoylamino]ethyl-dimethyl-ammonium Formula: C16H30N4O2+2 MolecularWeight: 310.435

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N4O2/c1-19(2)11-8-17-16(21)4-3-14-5-9-20(10-6-14)13-15-7-12-22-18-15/h7,12,14H,3-6,8-11,13H2,1-2H3,(H,17,21)/p+2