N-(4-fluorophenyl)-2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: N-(4-fluorophenyl)-2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-(4-fluorophenyl)-2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-(4-fluorophenyl)-2,2-dimethyl-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-(4-fluorophenyl)-2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-(4-fluorophenyl)-2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C15H23FN3O3S+ MolecularWeight: 344.424823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS(=O)(=O)N1CC[NH2+]CC1)C(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(CS(=O)(=O)N1CC[NH2+]CC1)C(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C15H22FN3O3S/c1-15(2,11-23(21,22)19-9-7-17-8-10-19)14(20)18-13-5-3-12(16)4-6-13/h3-6,17H,7-11H2,1-2H3,(H,18,20)/p+1