N-(4-azanyl-3-chloranyl-phenyl)-1,1,4-trimethyl-N-oxidanyl-piperazin-1-ium-2-carboxamide

Systemtic Name: N-(4-azanyl-3-chloranyl-phenyl)-1,1,4-trimethyl-N-oxidanyl-piperazin-1-ium-2-carboxamide Openeye Name: N-(4-amino-3-chloro-phenyl)-N-hydroxy-1,1,4-trimethyl-piperazin-1-ium-2-carboxamide CAS Name: N-(4-amino-3-chlorophenyl)-N-hydroxy-1,1,4-trimethyl-2-piperazin-1-iumcarboxamide IUPAC Name: N-(4-amino-3-chlorophenyl)-N-hydroxy-1,1,4-trimethylpiperazin-1-ium-2-carboxamide Traditional Name: N-(4-amino-3-chloro-phenyl)-N-hydroxy-1,1,4-trimethyl-piperazin-1-ium-2-carboxamide Formula: C14H22ClN4O2+ MolecularWeight: 313.80308

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](C(C1)C(=O)N(C2=CC(=C(C=C2)N)Cl)O)(C)C

Isomeric SMILES

CN1CC[N+](C(C1)C(=O)N(C2=CC(=C(C=C2)N)Cl)O)(C)C

InChI

InChI=1S/C14H22ClN4O2/c1-17-6-7-19(2,3)13(9-17)14(20)18(21)10-4-5-12(16)11(15)8-10/h4-5,8,13,21H,6-7,9,16H2,1-3H3/q+1