(2S)-4-methyl-2-pyridin-4-ylcarbonyloxy-pentanoic acid

Systemtic Name: (2S)-4-methyl-2-pyridin-4-ylcarbonyloxy-pentanoic acid Openeye Name: (2S)-4-methyl-2-(pyridine-4-carbonyloxy)pentanoic acid CAS Name: (2S)-4-methyl-2-[oxo(pyridin-4-yl)methoxy]pentanoic acid IUPAC Name: (2S)-4-methyl-2-(pyridine-4-carbonyloxy)pentanoic acid Traditional Name: (2S)-2-isonicotinoyloxy-4-methyl-valeric acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)OC(=O)C1=CC=NC=C1

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)OC(=O)C1=CC=NC=C1

InChI

InChI=1S/C12H15NO4/c1-8(2)7-10(11(14)15)17-12(16)9-3-5-13-6-4-9/h3-6,8,10H,7H2,1-2H3,(H,14,15)/t10-/m0/s1