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

Systemtic Name: (3R)-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]oxolan-2-one Openeye Name: (3R)-3-[4-[(E)-styryl]sulfonylpiperazin-1-ium-1-yl]tetrahydrofuran-2-one CAS Name: (3R)-3-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazin-1-iumyl]-2-oxolanone IUPAC Name: (3R)-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]oxolan-2-one Traditional Name: (3R)-3-[4-[(E)-styryl]sulfonylpiperazin-1-ium-1-yl]tetrahydrofuran-2-one Formula: C16H21N2O4S+ MolecularWeight: 337.41394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O4S/c19-16-15(6-12-22-16)17-8-10-18(11-9-17)23(20,21)13-7-14-4-2-1-3-5-14/h1-5,7,13,15H,6,8-12H2/p+1/b13-7+/t15-/m1/s1