N-ethyl-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylprop-2-enyl)ethanamide

Systemtic Name: N-ethyl-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylprop-2-enyl)ethanamide Openeye Name: N-ethyl-N-(2-methylallyl)-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-ethyl-2-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-methylprop-2-enyl)acetamide IUPAC Name: N-ethyl-2-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylprop-2-enyl)acetamide Traditional Name: N-ethyl-N-(2-methylallyl)-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C19H29N4O5S+ MolecularWeight: 425.52236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O5S/c1-5-21(13-15(2)3)19(24)14-20-8-10-22(11-9-20)29(27,28)18-12-17(23(25)26)7-6-16(18)4/h6-7,12H,2,5,8-11,13-14H2,1,3-4H3/p+1