N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-fluoranyl-benzamide Openeye Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-fluoro-benzamide CAS Name: N-[3-chloro-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-fluorobenzamide IUPAC Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-fluorobenzamide Traditional Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-fluoro-benzamide Formula: C18H20ClFN3O+ MolecularWeight: 348.822303

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3F)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3F)Cl

InChI

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