N-[4-[3-(3-methylimidazol-3-ium-1-yl)propyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[3-(3-methylimidazol-3-ium-1-yl)propyl]phenyl]methanesulfonamide Openeye Name: N-[4-[3-(3-methylimidazol-3-ium-1-yl)propyl]phenyl]methanesulfonamide CAS Name: N-[4-[3-(3-methyl-1-imidazol-3-iumyl)propyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[3-(3-methylimidazol-3-ium-1-yl)propyl]phenyl]methanesulfonamide Traditional Name: N-[4-[3-(3-methylimidazol-3-ium-1-yl)propyl]phenyl]methanesulfonamide Formula: C14H20N3O2S+ MolecularWeight: 294.3925

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CCCC2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

C[N+]1=CN(C=C1)CCCC2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C14H20N3O2S/c1-16-10-11-17(12-16)9-3-4-13-5-7-14(8-6-13)15-20(2,18)19/h5-8,10-12,15H,3-4,9H2,1-2H3/q+1