1-(phenylmethyl)sulfonyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium

Systemtic Name: 1-(phenylmethyl)sulfonyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium Openeye Name: 1-benzylsulfonyl-4-[(E)-cinnamyl]piperazin-4-ium CAS Name: 1-(phenylmethyl)sulfonyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium IUPAC Name: 1-benzylsulfonyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium Traditional Name: 1-benzylsulfonyl-4-[(E)-cinnamyl]piperazin-4-ium Formula: C20H25N2O2S+ MolecularWeight: 357.4897

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O2S/c23-25(24,18-20-10-5-2-6-11-20)22-16-14-21(15-17-22)13-7-12-19-8-3-1-4-9-19/h1-12H,13-18H2/p+1/b12-7+