N-(bromomethyl)-2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]-N-methyl-ethanamine

Systemtic Name: N-(bromomethyl)-2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]-N-methyl-ethanamine Openeye Name: N-(bromomethyl)-2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]-N-methyl-ethanamine CAS Name: N-(bromomethyl)-2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]-N-methylethanamine IUPAC Name: N-(bromomethyl)-2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]-N-methylethanamine Traditional Name: bromomethyl-[2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]ethyl]-methyl-amine Formula: C26H28BrNO MolecularWeight: 450.41062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN(C)CBr)C3=CC=CC=C3

Isomeric SMILES

CC/C(=C(/C1=CC=CC=C1)\C2=CC=C(C=C2)OCCN(C)CBr)/C3=CC=CC=C3

InChI

InChI=1S/C26H28BrNO/c1-3-25(21-10-6-4-7-11-21)26(22-12-8-5-9-13-22)23-14-16-24(17-15-23)29-19-18-28(2)20-27/h4-17H,3,18-20H2,1-2H3/b26-25+