1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine

Systemtic Name: 1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine Openeye Name: 1-[(5-bromo-2,4-dimethoxy-phenyl)methyl]-4-[(E)-cinnamyl]piperazine CAS Name: 1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine IUPAC Name: 1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine Traditional Name: 1-(5-bromo-2,4-dimethoxy-benzyl)-4-[(E)-cinnamyl]piperazine Formula: C22H27BrN2O2 MolecularWeight: 431.36598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CN2CCN(CC2)CC=CC3=CC=CC=C3)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1CN2CCN(CC2)C/C=C/C3=CC=CC=C3)Br)OC

InChI

InChI=1S/C22H27BrN2O2/c1-26-21-16-22(27-2)20(23)15-19(21)17-25-13-11-24(12-14-25)10-6-9-18-7-4-3-5-8-18/h3-9,15-16H,10-14,17H2,1-2H3/b9-6+