methyl 2-methoxy-4-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoate perchlorate

Systemtic Name: methyl 2-methoxy-4-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoate perchlorate Openeye Name: methyl 2-methoxy-4-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoate perchlorate CAS Name: 2-methoxy-4-(2,4,6-trimethyl-1-pyridin-1-iumyl)benzoic acid methyl ester perchlorate IUPAC Name: methyl 2-methoxy-4-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoate perchlorate Traditional Name: 2-methoxy-4-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoic acid methyl ester perchlorate Formula: C17H20ClNO7 MolecularWeight: 385.7962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20NO3.ClHO4/c1-11-8-12(2)18(13(3)9-11)14-6-7-15(17(19)21-5)16(10-14)20-4;2-1(3,4)5/h6-10H,1-5H3;(H,2,3,4,5)/q+1;/p-1