3-[2,4-dimethyl-2-(3-oxidanidyl-3-oxidanylidene-propyl)-3H-pyridin-3-yl]propanoate

Systemtic Name: 3-[2,4-dimethyl-2-(3-oxidanidyl-3-oxidanylidene-propyl)-3H-pyridin-3-yl]propanoate Openeye Name: 3-[2,4-dimethyl-2-(3-oxido-3-oxo-propyl)-3H-pyridin-3-yl]propanoate CAS Name: 3-[2,4-dimethyl-2-(3-oxido-3-oxopropyl)-3H-pyridin-3-yl]propanoate IUPAC Name: 3-[2,4-dimethyl-2-(3-oxido-3-oxopropyl)-3H-pyridin-3-yl]propanoate Traditional Name: 3-[2-(3-keto-3-oxido-propyl)-2,4-dimethyl-3H-pyridin-3-yl]propionate Formula: C13H17NO4-2 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NC(C1CCC(=O)[O-])(C)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=NC(C1CCC(=O)[O-])(C)CCC(=O)[O-]

InChI

InChI=1S/C13H19NO4/c1-9-6-8-14-13(2,7-5-12(17)18)10(9)3-4-11(15)16/h6,8,10H,3-5,7H2,1-2H3,(H,15,16)(H,17,18)/p-2