5-butyl-1-oxidanidyl-pyridin-1-ium-2-carboxylic acid

Systemtic Name: 5-butyl-1-oxidanidyl-pyridin-1-ium-2-carboxylic acid Openeye Name: 5-butyl-1-oxido-pyridin-1-ium-2-carboxylic acid CAS Name: 5-butyl-1-oxido-2-pyridin-1-iumcarboxylic acid IUPAC Name: 5-butyl-1-oxidopyridin-1-ium-2-carboxylic acid Traditional Name: 5-butyl-1-oxido-pyridin-1-ium-2-carboxylic acid Formula: C10H13NO3 MolecularWeight: 195.21512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C[N+](=C(C=C1)C(=O)O)[O-]

Isomeric SMILES

CCCCC1=C[N+](=C(C=C1)C(=O)O)[O-]

InChI

InChI=1S/C10H13NO3/c1-2-3-4-8-5-6-9(10(12)13)11(14)7-8/h5-7H,2-4H2,1H3,(H,12,13)