N-ethyl-N-(2-methylprop-2-enyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-ethyl-N-(2-methylprop-2-enyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-ethyl-N-(2-methylallyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-ethyl-N-(2-methylprop-2-enyl)-2-[4-(2-nitrophenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-ethyl-N-(2-methylprop-2-enyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-ethyl-N-(2-methylallyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C18H27N4O5S+ MolecularWeight: 411.49578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O5S/c1-4-20(13-15(2)3)18(23)14-19-9-11-21(12-10-19)28(26,27)17-8-6-5-7-16(17)22(24)25/h5-8H,2,4,9-14H2,1,3H3/p+1