N-methyl-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: N-methyl-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-N-methyl-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-methyl-2-[4-(2-nitrophenyl)sulfonyl-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: N-methyl-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-N-methyl-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C16H25N4O5S+ MolecularWeight: 385.4585

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N4O5S/c1-13(2)17(3)16(21)12-18-8-10-19(11-9-18)26(24,25)15-7-5-4-6-14(15)20(22)23/h4-7,13H,8-12H2,1-3H3/p+1