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

Systemtic Name: (5-chloranyl-2-ethoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone chloride Openeye Name: (5-chloro-2-ethoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone chloride CAS Name: (5-chloro-2-ethoxyphenyl)-(4-methyl-1-piperazin-4-iumyl)methanone chloride IUPAC Name: (5-chloro-2-ethoxyphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone chloride Traditional Name: (5-chloro-2-ethoxy-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone chloride Formula: C14H20Cl2N2O2 MolecularWeight: 319.2268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(=O)N2CC[NH+](CC2)C.[Cl-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(=O)N2CC[NH+](CC2)C.[Cl-]

InChI

InChI=1S/C14H19ClN2O2.ClH/c1-3-19-13-5-4-11(15)10-12(13)14(18)17-8-6-16(2)7-9-17;/h4-5,10H,3,6-9H2,1-2H3;1H