N,N-dimethyl-2-[4-[(E)-1-(4-phenylmethoxyphenyl)but-1-enyl]phenoxy]ethanamine

Systemtic Name: N,N-dimethyl-2-[4-[(E)-1-(4-phenylmethoxyphenyl)but-1-enyl]phenoxy]ethanamine Openeye Name: 2-[4-[(E)-1-(4-benzyloxyphenyl)but-1-enyl]phenoxy]-N,N-dimethyl-ethanamine CAS Name: N,N-dimethyl-2-[4-[(E)-1-(4-phenylmethoxyphenyl)but-1-enyl]phenoxy]ethanamine IUPAC Name: N,N-dimethyl-2-[4-[(E)-1-(4-phenylmethoxyphenyl)but-1-enyl]phenoxy]ethanamine Traditional Name: 2-[4-[(E)-1-(4-benzoxyphenyl)but-1-enyl]phenoxy]ethyl-dimethyl-amine Formula: C27H31NO2 MolecularWeight: 401.54054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C1=CC=C(C=C1)OCCN(C)C)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC/C=C(/C1=CC=C(C=C1)OCCN(C)C)\C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C27H31NO2/c1-4-8-27(23-11-15-25(16-12-23)29-20-19-28(2)3)24-13-17-26(18-14-24)30-21-22-9-6-5-7-10-22/h5-18H,4,19-21H2,1-3H3/b27-8-