(E)-N-ethyl-6,6-dimethyl-N-[3-[2-(3-thiophen-3-ylphenyl)ethoxy]propyl]hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N-ethyl-6,6-dimethyl-N-[3-[2-(3-thiophen-3-ylphenyl)ethoxy]propyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-ethyl-6,6-dimethyl-N-[3-[2-[3-(3-thienyl)phenyl]ethoxy]propyl]hept-2-en-4-yn-1-amine CAS Name: (E)-N-ethyl-6,6-dimethyl-N-[3-[2-[3-(3-thiophenyl)phenyl]ethoxy]propyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-ethyl-6,6-dimethyl-N-[3-[2-(3-thiophen-3-ylphenyl)ethoxy]propyl]hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-[3-[2-[3-(3-thienyl)phenyl]ethoxy]propyl]amine Formula: C26H35NOS MolecularWeight: 409.6272

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCOCCC1=CC=CC(=C1)C2=CSC=C2)CC=CC#CC(C)(C)C

Isomeric SMILES

CCN(CCCOCCC1=CC=CC(=C1)C2=CSC=C2)C/C=C/C#CC(C)(C)C

InChI

InChI=1S/C26H35NOS/c1-5-27(16-8-6-7-15-26(2,3)4)17-10-18-28-19-13-23-11-9-12-24(21-23)25-14-20-29-22-25/h6,8-9,11-12,14,20-22H,5,10,13,16-19H2,1-4H3/b8-6+