8-[4-[(E)-1-(4-iodophenyl)-2-phenyl-but-1-enyl]phenoxy]-N,N-dimethyl-octan-1-amine

Systemtic Name: 8-[4-[(E)-1-(4-iodophenyl)-2-phenyl-but-1-enyl]phenoxy]-N,N-dimethyl-octan-1-amine Openeye Name: 8-[4-[(E)-1-(4-iodophenyl)-2-phenyl-but-1-enyl]phenoxy]-N,N-dimethyl-octan-1-amine CAS Name: 8-[4-[(E)-1-(4-iodophenyl)-2-phenylbut-1-enyl]phenoxy]-N,N-dimethyl-1-octanamine IUPAC Name: 8-[4-[(E)-1-(4-iodophenyl)-2-phenylbut-1-enyl]phenoxy]-N,N-dimethyloctan-1-amine Traditional Name: 8-[4-[(E)-1-(4-iodophenyl)-2-phenyl-but-1-enyl]phenoxy]octyl-dimethyl-amine Formula: C32H40INO MolecularWeight: 581.57057

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)OCCCCCCCCN(C)C)C2=CC=C(C=C2)I)C3=CC=CC=C3

Isomeric SMILES

CC/C(=C(/C1=CC=C(C=C1)OCCCCCCCCN(C)C)\C2=CC=C(C=C2)I)/C3=CC=CC=C3

InChI

InChI=1S/C32H40INO/c1-4-31(26-14-10-9-11-15-26)32(27-16-20-29(33)21-17-27)28-18-22-30(23-19-28)35-25-13-8-6-5-7-12-24-34(2)3/h9-11,14-23H,4-8,12-13,24-25H2,1-3H3/b32-31-