1-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-4-ethyl-piperazin-4-ium

Systemtic Name: 1-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-4-ethyl-piperazin-4-ium Openeye Name: 1-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-4-ethyl-piperazin-4-ium CAS Name: 1-(2,5-diethoxy-4-methylphenyl)sulfonyl-4-ethylpiperazin-4-ium IUPAC Name: 1-(2,5-diethoxy-4-methylphenyl)sulfonyl-4-ethylpiperazin-4-ium Traditional Name: 1-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-4-ethyl-piperazin-4-ium Formula: C17H29N2O4S+ MolecularWeight: 357.48816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)OCC)C)OCC

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)OCC)C)OCC

InChI

InChI=1S/C17H28N2O4S/c1-5-18-8-10-19(11-9-18)24(20,21)17-13-15(22-6-2)14(4)12-16(17)23-7-3/h12-13H,5-11H2,1-4H3/p+1