4-(1-methylpyridin-1-ium-4-yl)isoquinoline perchlorate

Systemtic Name: 4-(1-methylpyridin-1-ium-4-yl)isoquinoline perchlorate Openeye Name: 4-(1-methylpyridin-1-ium-4-yl)isoquinoline perchlorate CAS Name: 4-(1-methyl-4-pyridin-1-iumyl)isoquinoline perchlorate IUPAC Name: 4-(1-methylpyridin-1-ium-4-yl)isoquinoline perchlorate Traditional Name: 4-(1-methylpyridin-1-ium-4-yl)isoquinoline perchlorate Formula: C15H13ClN2O4 MolecularWeight: 320.72772

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=CN=CC3=CC=CC=C32.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=CN=CC3=CC=CC=C32.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C15H13N2.ClHO4/c1-17-8-6-12(7-9-17)15-11-16-10-13-4-2-3-5-14(13)15;2-1(3,4)5/h2-11H,1H3;(H,2,3,4,5)/q+1;/p-1