N-[(2-fluorophenyl)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]methanesulfonamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]methanesulfonamide Openeye Name: N-[(2-fluorophenyl)methyl]-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanesulfonamide CAS Name: N-[(2-fluorophenyl)methyl]-N-[4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]methanesulfonamide IUPAC Name: N-[(2-fluorophenyl)methyl]-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanesulfonamide Traditional Name: N-(2-fluorobenzyl)-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanesulfonamide Formula: C20H25FN3O3S+ MolecularWeight: 406.494203

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3F)S(=O)(=O)C

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3F)S(=O)(=O)C

InChI

InChI=1S/C20H24FN3O3S/c1-22-11-13-23(14-12-22)20(25)16-7-9-18(10-8-16)24(28(2,26)27)15-17-5-3-4-6-19(17)21/h3-10H,11-15H2,1-2H3/p+1