N-[[(2R)-oxolan-2-yl]methyl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[[(2R)-oxolan-2-yl]methyl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide CAS Name: N-[[(2R)-2-oxolanyl]methyl]-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[[(2R)-oxolan-2-yl]methyl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: 2-(4-p-cumenylsulfonylpiperazin-1-ium-1-yl)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide Formula: C20H32N3O4S+ MolecularWeight: 410.55078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC3CCCO3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC[C@H]3CCCO3

InChI

InChI=1S/C20H31N3O4S/c1-16(2)17-5-7-19(8-6-17)28(25,26)23-11-9-22(10-12-23)15-20(24)21-14-18-4-3-13-27-18/h5-8,16,18H,3-4,9-15H2,1-2H3,(H,21,24)/p+1/t18-/m1/s1