N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-2-[4-[oxo-[(2R)-2-oxolanyl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-2-[4-[(2R)-oxolane-2-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C22H33N4O6S+ MolecularWeight: 481.58562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4CCCO4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCN(CC3)C(=O)[C@H]4CCCO4

InChI

InChI=1S/C22H32N4O6S/c1-17-4-5-18(33(29,30)26-10-13-31-14-11-26)15-19(17)23-21(27)16-24-6-8-25(9-7-24)22(28)20-3-2-12-32-20/h4-5,15,20H,2-3,6-14,16H2,1H3,(H,23,27)/p+1/t20-/m1/s1