4-ethynyl-1-methyl-pyridin-1-ium perchlorate

Systemtic Name: 4-ethynyl-1-methyl-pyridin-1-ium perchlorate Openeye Name: 4-ethynyl-1-methyl-pyridin-1-ium perchlorate CAS Name: 4-ethynyl-1-methylpyridin-1-ium perchlorate IUPAC Name: 4-ethynyl-1-methylpyridin-1-ium perchlorate Traditional Name: 4-ethynyl-1-methyl-pyridin-1-ium perchlorate Formula: C8H8ClNO4 MolecularWeight: 217.60642

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C#C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=CC=C(C=C1)C#C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C8H8N.ClHO4/c1-3-8-4-6-9(2)7-5-8;2-1(3,4)5/h1,4-7H,2H3;(H,2,3,4,5)/q+1;/p-1