2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-[[(2R)-oxolan-2-yl]methyl]ethanamide

Systemtic Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-[[(2R)-oxolan-2-yl]methyl]ethanamide Openeye Name: 2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide CAS Name: 2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-N-[[(2R)-2-oxolanyl]methyl]acetamide IUPAC Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-[[(2R)-oxolan-2-yl]methyl]acetamide Traditional Name: 2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1C[C@@H](OC1)CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H27N3O4S/c25-21(22-15-19-6-3-13-28-19)16-23-9-11-24(12-10-23)29(26,27)20-8-7-17-4-1-2-5-18(17)14-20/h1-2,4-5,7-8,14,19H,3,6,9-13,15-16H2,(H,22,25)/p+1/t19-/m1/s1