(E)-N,6,6-trimethyl-N-[(3-methyl-1-benzothiophen-7-yl)methyl]hept-2-en-4-yn-1-amine chloride

Systemtic Name: (E)-N,6,6-trimethyl-N-[(3-methyl-1-benzothiophen-7-yl)methyl]hept-2-en-4-yn-1-amine chloride Openeye Name: (E)-N,6,6-trimethyl-N-[(3-methylbenzothiophen-7-yl)methyl]hept-2-en-4-yn-1-amine chloride CAS Name: (E)-N,6,6-trimethyl-N-[(3-methyl-1-benzothiophen-7-yl)methyl]-1-hept-2-en-4-ynamine chloride IUPAC Name: (E)-N,6,6-trimethyl-N-[(3-methyl-1-benzothiophen-7-yl)methyl]hept-2-en-4-yn-1-amine chloride Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-[(3-methylbenzothiophen-7-yl)methyl]amine chloride Formula: C20H25ClNS- MolecularWeight: 346.9372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C1C=CC=C2CN(C)CC=CC#CC(C)(C)C.[Cl-]

Isomeric SMILES

CC1=CSC2=C1C=CC=C2CN(C)C/C=C/C#CC(C)(C)C.[Cl-]

InChI

InChI=1S/C20H25NS.ClH/c1-16-15-22-19-17(10-9-11-18(16)19)14-21(5)13-8-6-7-12-20(2,3)4;/h6,8-11,15H,13-14H2,1-5H3;1H/p-1/b8-6+;