2-[4-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-2-nitro-phenyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-2-nitro-phenyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-[4-[[(1S)-2-methoxy-1-methyl-ethyl]sulfamoyl]-2-nitro-phenyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-2-nitrophenyl]-1-piperazin-1-iumyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-2-nitrophenyl]piperazin-1-ium-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-[4-[[(1S)-2-methoxy-1-methyl-ethyl]sulfamoyl]-2-nitro-phenyl]piperazin-1-ium-1-yl]acetamide Formula: C19H30N5O6S+ MolecularWeight: 456.5364

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NS(=O)(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)NCC=C)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](COC)NS(=O)(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)NCC=C)[N+](=O)[O-]

InChI

InChI=1S/C19H29N5O6S/c1-4-7-20-19(25)13-22-8-10-23(11-9-22)17-6-5-16(12-18(17)24(26)27)31(28,29)21-15(2)14-30-3/h4-6,12,15,21H,1,7-11,13-14H2,2-3H3,(H,20,25)/p+1/t15-/m0/s1