(3S)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]thiolane 1,1-dioxide

Systemtic Name: (3S)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]thiolane 1,1-dioxide Openeye Name: (3S)-3-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]thiolane 1,1-dioxide CAS Name: (3S)-3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]thiolane 1,1-dioxide IUPAC Name: (3S)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]thiolane 1,1-dioxide Traditional Name: (3S)-3-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]sulfolane Formula: C17H25N2O2S+ MolecularWeight: 321.4576

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1N2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C17H24N2O2S/c20-22(21)14-8-17(15-22)19-12-10-18(11-13-19)9-4-7-16-5-2-1-3-6-16/h1-7,17H,8-15H2/p+1/b7-4+/t17-/m0/s1