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

Systemtic Name: 4-[4-[(E)-1-(4-iodophenyl)-2-phenyl-but-1-enyl]phenoxy]-N,N-dimethyl-butan-1-amine Openeye Name: 4-[4-[(E)-1-(4-iodophenyl)-2-phenyl-but-1-enyl]phenoxy]-N,N-dimethyl-butan-1-amine CAS Name: 4-[4-[(E)-1-(4-iodophenyl)-2-phenylbut-1-enyl]phenoxy]-N,N-dimethyl-1-butanamine IUPAC Name: 4-[4-[(E)-1-(4-iodophenyl)-2-phenylbut-1-enyl]phenoxy]-N,N-dimethylbutan-1-amine Traditional Name: 4-[4-[(E)-1-(4-iodophenyl)-2-phenyl-but-1-enyl]phenoxy]butyl-dimethyl-amine Formula: C28H32INO MolecularWeight: 525.46425

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32INO/c1-4-27(22-10-6-5-7-11-22)28(23-12-16-25(29)17-13-23)24-14-18-26(19-15-24)31-21-9-8-20-30(2)3/h5-7,10-19H,4,8-9,20-21H2,1-3H3/b28-27-