2-butyl-2-(2-pyridin-2-ylethyl)propanedioic acid

Systemtic Name: 2-butyl-2-(2-pyridin-2-ylethyl)propanedioic acid Openeye Name: 2-butyl-2-[2-(2-pyridyl)ethyl]propanedioic acid CAS Name: 2-butyl-2-[2-(2-pyridinyl)ethyl]propanedioic acid IUPAC Name: 2-butyl-2-(2-pyridin-2-ylethyl)propanedioic acid Traditional Name: 2-butyl-2-[2-(2-pyridyl)ethyl]malonic acid Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC1=CC=CC=N1)(C(=O)O)C(=O)O

Isomeric SMILES

CCCCC(CCC1=CC=CC=N1)(C(=O)O)C(=O)O

InChI

InChI=1S/C14H19NO4/c1-2-3-8-14(12(16)17,13(18)19)9-7-11-6-4-5-10-15-11/h4-6,10H,2-3,7-9H2,1H3,(H,16,17)(H,18,19)