(E)-N-(1-benzothiophen-3-ylmethyl)-N,6,6-trimethyl-hept-2-en-4-yn-1-amine hydrochloride

Systemtic Name: (E)-N-(1-benzothiophen-3-ylmethyl)-N,6,6-trimethyl-hept-2-en-4-yn-1-amine hydrochloride Openeye Name: (E)-N-(benzothiophen-3-ylmethyl)-N,6,6-trimethyl-hept-2-en-4-yn-1-amine hydrochloride CAS Name: (E)-N-(1-benzothiophen-3-ylmethyl)-N,6,6-trimethyl-1-hept-2-en-4-ynamine hydrochloride IUPAC Name: (E)-N-(1-benzothiophen-3-ylmethyl)-N,6,6-trimethylhept-2-en-4-yn-1-amine hydrochloride Traditional Name: benzothiophen-3-ylmethyl-[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amine hydrochloride Formula: C19H24ClNS MolecularWeight: 333.91856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCN(C)CC1=CSC2=CC=CC=C21.Cl

Isomeric SMILES

CC(C)(C)C#C/C=C/CN(C)CC1=CSC2=CC=CC=C21.Cl

InChI

InChI=1S/C19H23NS.ClH/c1-19(2,3)12-8-5-9-13-20(4)14-16-15-21-18-11-7-6-10-17(16)18;/h5-7,9-11,15H,13-14H2,1-4H3;1H/b9-5+;