(5-chloranyl-2-propoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone chloride

Systemtic Name: (5-chloranyl-2-propoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone chloride Openeye Name: (5-chloro-2-propoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone chloride CAS Name: (5-chloro-2-propoxyphenyl)-(4-methyl-1-piperazin-4-iumyl)methanone chloride IUPAC Name: (5-chloro-2-propoxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone chloride Traditional Name: (5-chloro-2-propoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone chloride Formula: C15H22Cl2N2O2 MolecularWeight: 333.25338

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Cl)C(=O)N2CC[NH+](CC2)C.[Cl-]

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Cl)C(=O)N2CC[NH+](CC2)C.[Cl-]

InChI

InChI=1S/C15H21ClN2O2.ClH/c1-3-10-20-14-5-4-12(16)11-13(14)15(19)18-8-6-17(2)7-9-18;/h4-5,11H,3,6-10H2,1-2H3;1H