2,6-dimethyl-4-(1-oxidanidylpyridin-1-ium-4-yl)benzoic acid

Systemtic Name: 2,6-dimethyl-4-(1-oxidanidylpyridin-1-ium-4-yl)benzoic acid Openeye Name: 2,6-dimethyl-4-(1-oxidopyridin-1-ium-4-yl)benzoic acid CAS Name: 2,6-dimethyl-4-(1-oxido-4-pyridin-1-iumyl)benzoic acid IUPAC Name: 2,6-dimethyl-4-(1-oxidopyridin-1-ium-4-yl)benzoic acid Traditional Name: 2,6-dimethyl-4-(1-oxidopyridin-1-ium-4-yl)benzoic acid Formula: C14H13NO3 MolecularWeight: 243.25792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)O)C)C2=CC=[N+](C=C2)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)O)C)C2=CC=[N+](C=C2)[O-]

InChI

InChI=1S/C14H13NO3/c1-9-7-12(8-10(2)13(9)14(16)17)11-3-5-15(18)6-4-11/h3-8H,1-2H3,(H,16,17)