(5-chloranyl-2-oxidanyl-phenyl)methyl-[3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-[3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-[3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-[3-(4-methyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-[3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-[3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C15H26ClN3O+2 MolecularWeight: 299.83944

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCC[NH2+]CC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

C[NH+]1CCN(CC1)CCC[NH2+]CC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C15H24ClN3O/c1-18-7-9-19(10-8-18)6-2-5-17-12-13-11-14(16)3-4-15(13)20/h3-4,11,17,20H,2,5-10,12H2,1H3/p+2