1-(phenylmethyl)-6-(2-thiophen-3-ylethynyl)-2,3,4,5-tetrahydropyridin-1-ium

Systemtic Name: 1-(phenylmethyl)-6-(2-thiophen-3-ylethynyl)-2,3,4,5-tetrahydropyridin-1-ium Openeye Name: 1-benzyl-6-[2-(3-thienyl)ethynyl]-2,3,4,5-tetrahydropyridin-1-ium CAS Name: 1-(phenylmethyl)-6-[2-(3-thiophenyl)ethynyl]-2,3,4,5-tetrahydropyridin-1-ium IUPAC Name: 1-benzyl-6-(2-thiophen-3-ylethynyl)-2,3,4,5-tetrahydropyridin-1-ium Traditional Name: 1-benzyl-6-[2-(3-thienyl)ethynyl]-2,3,4,5-tetrahydropyridin-1-ium Formula: C18H18NS+ MolecularWeight: 280.40722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C(C1)C#CC2=CSC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CC[N+](=C(C1)C#CC2=CSC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H18NS/c1-2-6-16(7-3-1)14-19-12-5-4-8-18(19)10-9-17-11-13-20-15-17/h1-3,6-7,11,13,15H,4-5,8,12,14H2/q+1