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

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyphenyl]acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)acetamide Formula: C21H33N4O6S+ MolecularWeight: 469.57492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCN(CC3)C(=O)C

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H32N4O6S/c1-16(2)31-20-5-4-18(32(28,29)25-10-12-30-13-11-25)14-19(20)22-21(27)15-23-6-8-24(9-7-23)17(3)26/h4-5,14,16H,6-13,15H2,1-3H3,(H,22,27)/p+1