1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium

Systemtic Name: 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-4-[(E)-cinnamyl]piperazin-4-ium CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium Traditional Name: 1-(4-benzoxy-3-methoxy-benzyl)-4-[(E)-cinnamyl]piperazin-4-ium Formula: C28H33N2O2+ MolecularWeight: 429.57382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CC[NH+](CC2)CC=CC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CC[NH+](CC2)C/C=C/C3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H32N2O2/c1-31-28-21-26(14-15-27(28)32-23-25-11-6-3-7-12-25)22-30-19-17-29(18-20-30)16-8-13-24-9-4-2-5-10-24/h2-15,21H,16-20,22-23H2,1H3/p+1/b13-8+