2-(3-pyridin-4-ylpropoxy)butanoic acid

Systemtic Name: 2-(3-pyridin-4-ylpropoxy)butanoic acid Openeye Name: 2-[3-(4-pyridyl)propoxy]butanoic acid CAS Name: 2-(3-pyridin-4-ylpropoxy)butanoic acid IUPAC Name: 2-(3-pyridin-4-ylpropoxy)butanoic acid Traditional Name: 2-[3-(4-pyridyl)propoxy]butyric acid Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OCCCC1=CC=NC=C1

Isomeric SMILES

CCC(C(=O)O)OCCCC1=CC=NC=C1

InChI

InChI=1S/C12H17NO3/c1-2-11(12(14)15)16-9-3-4-10-5-7-13-8-6-10/h5-8,11H,2-4,9H2,1H3,(H,14,15)