4-(2-azanyl-2-oxidanylidene-ethyl)-4-[2,4,6-tris(chloranyl)phenyl]piperazin-4-ium-2-carboxamide

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethyl)-4-[2,4,6-tris(chloranyl)phenyl]piperazin-4-ium-2-carboxamide Openeye Name: 4-(2-amino-2-oxo-ethyl)-4-(2,4,6-trichlorophenyl)piperazin-4-ium-2-carboxamide CAS Name: 4-(2-amino-2-oxoethyl)-4-(2,4,6-trichlorophenyl)-2-piperazin-4-iumcarboxamide IUPAC Name: 4-(2-amino-2-oxoethyl)-4-(2,4,6-trichlorophenyl)piperazin-4-ium-2-carboxamide Traditional Name: 4-(2-amino-2-keto-ethyl)-4-(2,4,6-trichlorophenyl)piperazin-4-ium-2-carboxamide Formula: C13H16Cl3N4O2+ MolecularWeight: 366.65074

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CC(N1)C(=O)N)(CC(=O)N)C2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

C1C[N+](CC(N1)C(=O)N)(CC(=O)N)C2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C13H15Cl3N4O2/c14-7-3-8(15)12(9(16)4-7)20(6-11(17)21)2-1-19-10(5-20)13(18)22/h3-4,10,19H,1-2,5-6H2,(H3-,17,18,21,22)/p+1