pyridin-1-ium-3-ylmethyl-[2,2,2-tris(chloranyl)-1-(propanoylamino)ethyl]azanium

Systemtic Name: pyridin-1-ium-3-ylmethyl-[2,2,2-tris(chloranyl)-1-(propanoylamino)ethyl]azanium Openeye Name: pyridin-1-ium-3-ylmethyl-[2,2,2-trichloro-1-(propanoylamino)ethyl]ammonium CAS Name: 3-pyridin-1-iumylmethyl-[2,2,2-trichloro-1-(1-oxopropylamino)ethyl]ammonium IUPAC Name: pyridin-1-ium-3-ylmethyl-[2,2,2-trichloro-1-(propanoylamino)ethyl]azanium Traditional Name: pyridin-1-ium-3-ylmethyl-(2,2,2-trichloro-1-propionamido-ethyl)ammonium Formula: C11H16Cl3N3O+2 MolecularWeight: 312.62324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C(Cl)(Cl)Cl)[NH2+]CC1=C[NH+]=CC=C1

Isomeric SMILES

CCC(=O)NC(C(Cl)(Cl)Cl)[NH2+]CC1=C[NH+]=CC=C1

InChI

InChI=1S/C11H14Cl3N3O/c1-2-9(18)17-10(11(12,13)14)16-7-8-4-3-5-15-6-8/h3-6,10,16H,2,7H2,1H3,(H,17,18)/p+2