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

Systemtic Name: N-[4-[3-(3-methylimidazol-3-ium-1-yl)propanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[3-(3-methylimidazol-3-ium-1-yl)propanoyl]phenyl]methanesulfonamide CAS Name: N-[4-[3-(3-methyl-1-imidazol-3-iumyl)-1-oxopropyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[3-(3-methylimidazol-3-ium-1-yl)propanoyl]phenyl]methanesulfonamide Traditional Name: N-[4-[3-(3-methylimidazol-3-ium-1-yl)propanoyl]phenyl]methanesulfonamide Formula: C14H18N3O3S+ MolecularWeight: 308.37602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3S/c1-16-9-10-17(11-16)8-7-14(18)12-3-5-13(6-4-12)15-21(2,19)20/h3-6,9-11H,7-8H2,1-2H3/p+1