5-octoxycarbonyl-3-propoxy-pyridine-2-carboxylic acid

Systemtic Name: 5-octoxycarbonyl-3-propoxy-pyridine-2-carboxylic acid Openeye Name: 5-octoxycarbonyl-3-propoxy-pyridine-2-carboxylic acid CAS Name: 5-[octoxy(oxo)methyl]-3-propoxy-2-pyridinecarboxylic acid IUPAC Name: 5-octoxycarbonyl-3-propoxypyridine-2-carboxylic acid Traditional Name: 5-octoxycarbonyl-3-propoxy-picolinic acid Formula: C18H27NO5 MolecularWeight: 337.41068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC(=C(N=C1)C(=O)O)OCCC

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC(=C(N=C1)C(=O)O)OCCC

InChI

InChI=1S/C18H27NO5/c1-3-5-6-7-8-9-11-24-18(22)14-12-15(23-10-4-2)16(17(20)21)19-13-14/h12-13H,3-11H2,1-2H3,(H,20,21)