methyl N-[5-chloranyl-2-oxidanyl-4-[(1,1,4-trimethylpiperazin-1-ium-2-yl)carbonylamino]phenyl]carbamate

Systemtic Name: methyl N-[5-chloranyl-2-oxidanyl-4-[(1,1,4-trimethylpiperazin-1-ium-2-yl)carbonylamino]phenyl]carbamate Openeye Name: methyl N-[5-chloro-2-hydroxy-4-[(1,1,4-trimethylpiperazin-1-ium-2-carbonyl)amino]phenyl]carbamate CAS Name: N-[5-chloro-2-hydroxy-4-[[oxo-(1,1,4-trimethyl-2-piperazin-1-iumyl)methyl]amino]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[5-chloro-2-hydroxy-4-[(1,1,4-trimethylpiperazin-1-ium-2-carbonyl)amino]phenyl]carbamate Traditional Name: N-[5-chloro-2-hydroxy-4-[(1,1,4-trimethylpiperazin-1-ium-2-carbonyl)amino]phenyl]carbamic acid methyl ester Formula: C16H24ClN4O4+ MolecularWeight: 371.83916

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](C(C1)C(=O)NC2=CC(=C(C=C2Cl)NC(=O)OC)O)(C)C

Isomeric SMILES

CN1CC[N+](C(C1)C(=O)NC2=CC(=C(C=C2Cl)NC(=O)OC)O)(C)C

InChI

InChI=1S/C16H23ClN4O4/c1-20-5-6-21(2,3)13(9-20)15(23)18-11-8-14(22)12(7-10(11)17)19-16(24)25-4/h7-8,13H,5-6,9H2,1-4H3,(H2-,18,19,22,23,24)/p+1