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

Systemtic Name: 1-[(E)-3-phenylprop-2-enyl]-4-[(3S)-thiolan-3-yl]piperazin-1-ium Openeye Name: 1-[(E)-cinnamyl]-4-[(3S)-tetrahydrothiophen-3-yl]piperazin-1-ium CAS Name: 1-[(E)-3-phenylprop-2-enyl]-4-[(3S)-3-thiolanyl]piperazin-1-ium IUPAC Name: 1-[(E)-3-phenylprop-2-enyl]-4-[(3S)-thiolan-3-yl]piperazin-1-ium Traditional Name: 1-[(E)-cinnamyl]-4-[(3S)-tetrahydrothiophen-3-yl]piperazin-1-ium Formula: C17H25N2S+ MolecularWeight: 289.4588

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC1N2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

C1CSC[C@H]1N2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C17H24N2S/c1-2-5-16(6-3-1)7-4-9-18-10-12-19(13-11-18)17-8-14-20-15-17/h1-7,17H,8-15H2/p+1/b7-4+/t17-/m0/s1