N-[4-acetamido-3,5-bis(chloranyl)phenyl]-1,1-dimethyl-N-oxidanyl-piperazin-1-ium-2-carboxamide

Systemtic Name: N-[4-acetamido-3,5-bis(chloranyl)phenyl]-1,1-dimethyl-N-oxidanyl-piperazin-1-ium-2-carboxamide Openeye Name: N-(4-acetamido-3,5-dichloro-phenyl)-N-hydroxy-1,1-dimethyl-piperazin-1-ium-2-carboxamide CAS Name: N-(4-acetamido-3,5-dichlorophenyl)-N-hydroxy-1,1-dimethyl-2-piperazin-1-iumcarboxamide IUPAC Name: N-(4-acetamido-3,5-dichlorophenyl)-N-hydroxy-1,1-dimethylpiperazin-1-ium-2-carboxamide Traditional Name: N-(4-acetamido-3,5-dichloro-phenyl)-N-hydroxy-1,1-dimethyl-piperazin-1-ium-2-carboxamide Formula: C15H21Cl2N4O3+ MolecularWeight: 376.25824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1Cl)N(C(=O)C2CNCC[N+]2(C)C)O)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1Cl)N(C(=O)C2CNCC[N+]2(C)C)O)Cl

InChI

InChI=1S/C15H20Cl2N4O3/c1-9(22)19-14-11(16)6-10(7-12(14)17)20(24)15(23)13-8-18-4-5-21(13,2)3/h6-7,13,18,24H,4-5,8H2,1-3H3/p+1