1-[2-[(4-iodophenyl)-phenyl-methoxy]ethyl]-4-[(E)-3-phenylprop-2-enyl]piperazine

Systemtic Name: 1-[2-[(4-iodophenyl)-phenyl-methoxy]ethyl]-4-[(E)-3-phenylprop-2-enyl]piperazine Openeye Name: 1-[(E)-cinnamyl]-4-[2-[(4-iodophenyl)-phenyl-methoxy]ethyl]piperazine CAS Name: 1-[2-[(4-iodophenyl)-phenylmethoxy]ethyl]-4-[(E)-3-phenylprop-2-enyl]piperazine IUPAC Name: 1-[2-[(4-iodophenyl)-phenylmethoxy]ethyl]-4-[(E)-3-phenylprop-2-enyl]piperazine Traditional Name: 1-[(E)-cinnamyl]-4-[2-[(4-iodophenyl)-phenyl-methoxy]ethyl]piperazine Formula: C28H31IN2O MolecularWeight: 538.46301

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)I)CC=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)I)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C28H31IN2O/c29-27-15-13-26(14-16-27)28(25-11-5-2-6-12-25)32-23-22-31-20-18-30(19-21-31)17-7-10-24-8-3-1-4-9-24/h1-16,28H,17-23H2/b10-7+