N-[3-(1H-imidazol-1-ium-1-yl)propyl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-4-methoxy-benzenesulfonamide Openeye Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-4-methoxy-benzenesulfonamide CAS Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-4-methoxybenzenesulfonamide Traditional Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-4-methoxy-benzenesulfonamide Formula: C13H18N3O3S+ MolecularWeight: 296.36532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCCC[NH+]2C=CN=C2

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCCC[NH+]2C=CN=C2

InChI

InChI=1S/C13H17N3O3S/c1-19-12-3-5-13(6-4-12)20(17,18)15-7-2-9-16-10-8-14-11-16/h3-6,8,10-11,15H,2,7,9H2,1H3/p+1