6-[2-(4-chlorophenyl)ethynyl]-1-prop-2-enyl-2,3,4,5-tetrahydropyridin-1-ium

Systemtic Name: 6-[2-(4-chlorophenyl)ethynyl]-1-prop-2-enyl-2,3,4,5-tetrahydropyridin-1-ium Openeye Name: 1-allyl-6-[2-(4-chlorophenyl)ethynyl]-2,3,4,5-tetrahydropyridin-1-ium CAS Name: 6-[2-(4-chlorophenyl)ethynyl]-1-prop-2-enyl-2,3,4,5-tetrahydropyridin-1-ium IUPAC Name: 6-[2-(4-chlorophenyl)ethynyl]-1-prop-2-enyl-2,3,4,5-tetrahydropyridin-1-ium Traditional Name: 1-allyl-6-[2-(4-chlorophenyl)ethynyl]-2,3,4,5-tetrahydropyridin-1-ium Formula: C16H17ClN+ MolecularWeight: 258.76588

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=C(CCCC1)C#CC2=CC=C(C=C2)Cl

Isomeric SMILES

C=CC[N+]1=C(CCCC1)C#CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClN/c1-2-12-18-13-4-3-5-16(18)11-8-14-6-9-15(17)10-7-14/h2,6-7,9-10H,1,3-5,12-13H2/q+1