6-[di(propan-2-yl)carbamoyl]-1-oxidanidyl-pyridin-1-ium-2-carboxylic acid

Systemtic Name: 6-[di(propan-2-yl)carbamoyl]-1-oxidanidyl-pyridin-1-ium-2-carboxylic acid Openeye Name: 6-(diisopropylcarbamoyl)-1-oxido-pyridin-1-ium-2-carboxylic acid CAS Name: 6-[[di(propan-2-yl)amino]-oxomethyl]-1-oxido-2-pyridin-1-iumcarboxylic acid IUPAC Name: 6-[di(propan-2-yl)carbamoyl]-1-oxidopyridin-1-ium-2-carboxylic acid Traditional Name: 6-(diisopropylcarbamoyl)-1-oxido-pyridin-1-ium-2-carboxylic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4/c1-8(2)14(9(3)4)12(16)10-6-5-7-11(13(17)18)15(10)19/h5-9H,1-4H3,(H,17,18)