N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[5-methoxy-2-(2-phenylethynyl)phenyl]propan-2-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[5-methoxy-2-(2-phenylethynyl)phenyl]propan-2-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[5-methoxy-2-(2-phenylethynyl)phenyl]propan-2-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[5-methoxy-2-(2-phenylethynyl)phenyl]-2-propanamine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[5-methoxy-2-(2-phenylethynyl)phenyl]propan-2-amine Traditional Name: homoveratryl-[2-[5-methoxy-2-(2-phenylethynyl)phenyl]-1-methyl-ethyl]amine Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C=CC(=C1)OC)C#CC2=CC=CC=C2)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(CC1=C(C=CC(=C1)OC)C#CC2=CC=CC=C2)NCCC3=CC(=C(C=C3)OC)OC

InChI

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