4-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-N,N-dimethyl-piperazin-4-ium-1-sulfonamide

Systemtic Name: 4-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-N,N-dimethyl-piperazin-4-ium-1-sulfonamide Openeye Name: 4-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethyl]-N,N-dimethyl-piperazin-4-ium-1-sulfonamide CAS Name: 4-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl]-N,N-dimethyl-1-piperazin-4-iumsulfonamide IUPAC Name: 4-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethyl]-N,N-dimethylpiperazin-4-ium-1-sulfonamide Traditional Name: 4-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethyl]-N,N-dimethyl-piperazin-4-ium-1-sulfonamide Formula: C17H31N4O3S+ MolecularWeight: 371.51804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)N(C)C)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C17H30N4O3S/c1-6-7-21-14(2)12-16(15(21)3)17(22)13-19-8-10-20(11-9-19)25(23,24)18(4)5/h12H,6-11,13H2,1-5H3/p+1