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

Systemtic Name: (E)-6,6-dimethyl-N-[3-[2-(3-thiophen-3-ylphenyl)ethoxy]propyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-6,6-dimethyl-N-[3-[2-[3-(3-thienyl)phenyl]ethoxy]propyl]hept-2-en-4-yn-1-amine CAS Name: (E)-6,6-dimethyl-N-[3-[2-[3-(3-thiophenyl)phenyl]ethoxy]propyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-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]-[3-[2-[3-(3-thienyl)phenyl]ethoxy]propyl]amine Formula: C24H31NOS MolecularWeight: 381.57404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCNCCCOCCC1=CC=CC(=C1)C2=CSC=C2

Isomeric SMILES

CC(C)(C)C#C/C=C/CNCCCOCCC1=CC=CC(=C1)C2=CSC=C2

InChI

InChI=1S/C24H31NOS/c1-24(2,3)13-5-4-6-14-25-15-8-16-26-17-11-21-9-7-10-22(19-21)23-12-18-27-20-23/h4,6-7,9-10,12,18-20,25H,8,11,14-17H2,1-3H3/b6-4+