2-(3-cyano-1-methoxycarbonyl-4H-pyridin-4-yl)-2-methyl-propanoic acid

Systemtic Name: 2-(3-cyano-1-methoxycarbonyl-4H-pyridin-4-yl)-2-methyl-propanoic acid Openeye Name: 2-(3-cyano-1-methoxycarbonyl-4H-pyridin-4-yl)-2-methyl-propanoic acid CAS Name: 2-(3-cyano-1-methoxycarbonyl-4H-pyridin-4-yl)-2-methylpropanoic acid IUPAC Name: 2-(3-cyano-1-methoxycarbonyl-4H-pyridin-4-yl)-2-methylpropanoic acid Traditional Name: 2-(1-carbomethoxy-3-cyano-4H-pyridin-4-yl)-2-methyl-propionic acid Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C=CN(C=C1C#N)C(=O)OC)C(=O)O

Isomeric SMILES

CC(C)(C1C=CN(C=C1C#N)C(=O)OC)C(=O)O

InChI

InChI=1S/C12H14N2O4/c1-12(2,10(15)16)9-4-5-14(11(17)18-3)7-8(9)6-13/h4-5,7,9H,1-3H3,(H,15,16)