4-chloranyl-N-[3-fluoranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide chloride

Systemtic Name: 4-chloranyl-N-[3-fluoranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide chloride Openeye Name: 4-chloro-N-[3-fluoro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide chloride CAS Name: 4-chloro-N-[3-fluoro-4-(4-methyl-1-piperazin-4-iumyl)phenyl]benzamide chloride IUPAC Name: 4-chloro-N-[3-fluoro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide chloride Traditional Name: 4-chloro-N-[3-fluoro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide chloride Formula: C18H20Cl2FN3O MolecularWeight: 384.275303

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)F.[Cl-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)F.[Cl-]

InChI

InChI=1S/C18H19ClFN3O.ClH/c1-22-8-10-23(11-9-22)17-7-6-15(12-16(17)20)21-18(24)13-2-4-14(19)5-3-13;/h2-7,12H,8-11H2,1H3,(H,21,24);1H