2-(3,4-dimethoxyphenyl)-N-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]-N-methyl-ethanamine

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]-N-methyl-ethanamine Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]-N-methyl-ethanamine CAS Name: 2-(3,4-dimethoxyphenyl)-N-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]-N-methylethanamine IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]-N-methylethanamine Traditional Name: homoveratryl-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]-methyl-amine Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)CCC2=C(C=CC(=C2)OC)C#CC3=CC=CC=C3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)CCC2=C(C=CC(=C2)OC)C#CC3=CC=CC=C3

InChI

InChI=1S/C28H31NO3/c1-29(18-16-23-11-15-27(31-3)28(20-23)32-4)19-17-25-21-26(30-2)14-13-24(25)12-10-22-8-6-5-7-9-22/h5-9,11,13-15,20-21H,16-19H2,1-4H3