2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone CAS Name: 2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone Formula: C25H34N4O2+2 MolecularWeight: 422.56306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C25H32N4O2/c30-24-10-8-23(9-11-24)28-17-15-27(16-18-28)21-25(31)29-19-13-26(14-20-29)12-4-7-22-5-2-1-3-6-22/h1-11,30H,12-21H2/p+2/b7-4+