1-[(3,5-dimethoxyphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium

Systemtic Name: 1-[(3,5-dimethoxyphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium Openeye Name: 1-[(E)-cinnamyl]-4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-ium CAS Name: 1-[(3,5-dimethoxyphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium IUPAC Name: 1-[(3,5-dimethoxyphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium Traditional Name: 1-[(E)-cinnamyl]-4-(3,5-dimethoxybenzyl)piperazin-1-ium Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CN2CC[NH+](CC2)CC=CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CN2CC[NH+](CC2)C/C=C/C3=CC=CC=C3)OC

InChI

InChI=1S/C22H28N2O2/c1-25-21-15-20(16-22(17-21)26-2)18-24-13-11-23(12-14-24)10-6-9-19-7-4-3-5-8-19/h3-9,15-17H,10-14,18H2,1-2H3/p+1/b9-6+