(3R)-3-[4-(phenylmethyl)sulfonylpiperazin-1-ium-1-yl]oxolan-2-one

Systemtic Name: (3R)-3-[4-(phenylmethyl)sulfonylpiperazin-1-ium-1-yl]oxolan-2-one Openeye Name: (3R)-3-(4-benzylsulfonylpiperazin-1-ium-1-yl)tetrahydrofuran-2-one CAS Name: (3R)-3-[4-(phenylmethyl)sulfonyl-1-piperazin-1-iumyl]-2-oxolanone IUPAC Name: (3R)-3-(4-benzylsulfonylpiperazin-1-ium-1-yl)oxolan-2-one Traditional Name: (3R)-3-(4-benzylsulfonylpiperazin-1-ium-1-yl)tetrahydrofuran-2-one Formula: C15H21N2O4S+ MolecularWeight: 325.40324

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1[NH+]2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1COC(=O)[C@@H]1[NH+]2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C15H20N2O4S/c18-15-14(6-11-21-15)16-7-9-17(10-8-16)22(19,20)12-13-4-2-1-3-5-13/h1-5,14H,6-12H2/p+1/t14-/m1/s1