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

Systemtic Name: 2-(1-methoxycarbonyl-4H-pyridin-4-yl)-3-methyl-butanoic acid Openeye Name: 2-(1-methoxycarbonyl-4H-pyridin-4-yl)-3-methyl-butanoic acid CAS Name: 2-(1-methoxycarbonyl-4H-pyridin-4-yl)-3-methylbutanoic acid IUPAC Name: 2-(1-methoxycarbonyl-4H-pyridin-4-yl)-3-methylbutanoic acid Traditional Name: 2-(1-carbomethoxy-4H-pyridin-4-yl)-3-methyl-butyric acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1C=CN(C=C1)C(=O)OC)C(=O)O

Isomeric SMILES

CC(C)C(C1C=CN(C=C1)C(=O)OC)C(=O)O

InChI

InChI=1S/C12H17NO4/c1-8(2)10(11(14)15)9-4-6-13(7-5-9)12(16)17-3/h4-10H,1-3H3,(H,14,15)