methyl 1-cyano-2-methyl-quinolizin-5-ium-4-carboxylate perchlorate

Systemtic Name: methyl 1-cyano-2-methyl-quinolizin-5-ium-4-carboxylate perchlorate Openeye Name: methyl 1-cyano-2-methyl-quinolizin-5-ium-4-carboxylate perchlorate CAS Name: 1-cyano-2-methyl-4-quinolizin-5-iumcarboxylic acid methyl ester perchlorate IUPAC Name: methyl 1-cyano-2-methylquinolizin-5-ium-4-carboxylate perchlorate Traditional Name: 1-cyano-2-methyl-quinolizin-5-ium-4-carboxylic acid methyl ester perchlorate Formula: C13H11ClN2O6 MolecularWeight: 326.68924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=[N+]2C(=C1)C(=O)OC)C#N.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=C(C2=CC=CC=[N+]2C(=C1)C(=O)OC)C#N.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H11N2O2.ClHO4/c1-9-7-12(13(16)17-2)15-6-4-3-5-11(15)10(9)8-14;2-1(3,4)5/h3-7H,1-2H3;(H,2,3,4,5)/q+1;/p-1