3-[(4-chlorophenyl)methoxy]-5-heptoxycarbonyl-pyridine-2-carboxylic acid

Systemtic Name: 3-[(4-chlorophenyl)methoxy]-5-heptoxycarbonyl-pyridine-2-carboxylic acid Openeye Name: 3-[(4-chlorophenyl)methoxy]-5-heptoxycarbonyl-pyridine-2-carboxylic acid CAS Name: 3-[(4-chlorophenyl)methoxy]-5-[heptoxy(oxo)methyl]-2-pyridinecarboxylic acid IUPAC Name: 3-[(4-chlorophenyl)methoxy]-5-heptoxycarbonylpyridine-2-carboxylic acid Traditional Name: 3-(4-chlorobenzyl)oxy-5-heptoxycarbonyl-picolinic acid Formula: C21H24ClNO5 MolecularWeight: 405.87196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CC(=C(N=C1)C(=O)O)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCCOC(=O)C1=CC(=C(N=C1)C(=O)O)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClNO5/c1-2-3-4-5-6-11-27-21(26)16-12-18(19(20(24)25)23-13-16)28-14-15-7-9-17(22)10-8-15/h7-10,12-13H,2-6,11,14H2,1H3,(H,24,25)