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

Systemtic Name: 1-(1-ethylpyrazol-4-yl)sulfonyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium Openeye Name: 1-[(E)-cinnamyl]-4-(1-ethylpyrazol-4-yl)sulfonyl-piperazin-1-ium CAS Name: 1-[(1-ethyl-4-pyrazolyl)sulfonyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium IUPAC Name: 1-(1-ethylpyrazol-4-yl)sulfonyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium Traditional Name: 1-[(E)-cinnamyl]-4-(1-ethylpyrazol-4-yl)sulfonyl-piperazin-1-ium Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)S(=O)(=O)N2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CCN1C=C(C=N1)S(=O)(=O)N2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C18H24N4O2S/c1-2-21-16-18(15-19-21)25(23,24)22-13-11-20(12-14-22)10-6-9-17-7-4-3-5-8-17/h3-9,15-16H,2,10-14H2,1H3/p+1/b9-6+