2-(4-ethanoylpiperazin-1-ium-1-yl)-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-isopropoxy-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyphenyl]acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(2-isopropoxy-5-piperidinosulfonyl-phenyl)acetamide Formula: C22H35N4O5S+ MolecularWeight: 467.6021

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH+]3CCN(CC3)C(=O)C

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH+]3CCN(CC3)C(=O)C

InChI

InChI=1S/C22H34N4O5S/c1-17(2)31-21-8-7-19(32(29,30)26-9-5-4-6-10-26)15-20(21)23-22(28)16-24-11-13-25(14-12-24)18(3)27/h7-8,15,17H,4-6,9-14,16H2,1-3H3,(H,23,28)/p+1