3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]chromen-4-one

Systemtic Name: 3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]chromen-4-one Openeye Name: 3-[[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methyl]chromen-4-one CAS Name: 3-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methyl]-1-benzopyran-4-one IUPAC Name: 3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]chromen-4-one Traditional Name: 3-[[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methyl]chromone Formula: C23H25N2O2+ MolecularWeight: 361.4568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)CC3=COC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)CC3=COC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H24N2O2/c26-23-20(18-27-22-11-5-4-10-21(22)23)17-25-15-13-24(14-16-25)12-6-9-19-7-2-1-3-8-19/h1-11,18H,12-17H2/p+1/b9-6+