1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[3-(3-iodanylphenyl)propyl]piperazine

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[3-(3-iodanylphenyl)propyl]piperazine Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[3-(3-iodanylphenyl)propyl]piperazine CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[3-(3-iodanylphenyl)propyl]piperazine IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[3-(3-iodanylphenyl)propyl]piperazine Traditional Name: 1-homoveratryl-4-[3-(3-iodanylphenyl)propyl]piperazine Formula: C23H31IN2O2 MolecularWeight: 492.409064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CCN(CC2)CCCC3=CC(=CC=C3)I)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CCN(CC2)CCCC3=CC(=CC=C3)[125I])OC

InChI

InChI=1S/C23H31IN2O2/c1-27-22-9-8-20(18-23(22)28-2)10-12-26-15-13-25(14-16-26)11-4-6-19-5-3-7-21(24)17-19/h3,5,7-9,17-18H,4,6,10-16H2,1-2H3/i24-2