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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]ethanamine Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]ethanamine CAS Name: 2-(3,4-dimethoxyphenyl)-N-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]ethanamine IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]ethanamine Traditional Name: homoveratryl-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]ethyl]amine Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C#CC2=CC=CC=C2)CCNCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C#CC2=CC=CC=C2)CCNCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C27H29NO3/c1-29-25-13-12-23(11-9-21-7-5-4-6-8-21)24(20-25)16-18-28-17-15-22-10-14-26(30-2)27(19-22)31-3/h4-8,10,12-14,19-20,28H,15-18H2,1-3H3