(4,5-dimethoxy-2-methyl-phenyl)methyl 1-oxidanidylpyridin-1-ium-4-carboxylate

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 1-oxidanidylpyridin-1-ium-4-carboxylate Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 1-oxidopyridin-1-ium-4-carboxylate CAS Name: 1-oxido-4-pyridin-1-iumcarboxylic acid (4,5-dimethoxy-2-methylphenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl 1-oxidopyridin-1-ium-4-carboxylate Traditional Name: 1-oxidopyridin-1-ium-4-carboxylic acid (4,5-dimethoxy-2-methyl-benzyl) ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1COC(=O)C2=CC=[N+](C=C2)[O-])OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1COC(=O)C2=CC=[N+](C=C2)[O-])OC)OC

InChI

InChI=1S/C16H17NO5/c1-11-8-14(20-2)15(21-3)9-13(11)10-22-16(18)12-4-6-17(19)7-5-12/h4-9H,10H2,1-3H3