[2-(2-ethoxypyridin-4-yl)phenyl] 6-methyloctanoate

Systemtic Name: [2-(2-ethoxypyridin-4-yl)phenyl] 6-methyloctanoate Openeye Name: [2-(2-ethoxy-4-pyridyl)phenyl] 6-methyloctanoate CAS Name: 6-methyloctanoic acid [2-(2-ethoxy-4-pyridinyl)phenyl] ester IUPAC Name: [2-(2-ethoxypyridin-4-yl)phenyl] 6-methyloctanoate Traditional Name: 6-methylcaprylic acid [2-(2-ethoxy-4-pyridyl)phenyl] ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCCC(=O)OC1=CC=CC=C1C2=CC(=NC=C2)OCC

Isomeric SMILES

CCC(C)CCCCC(=O)OC1=CC=CC=C1C2=CC(=NC=C2)OCC

InChI

InChI=1S/C22H29NO3/c1-4-17(3)10-6-9-13-22(24)26-20-12-8-7-11-19(20)18-14-15-23-21(16-18)25-5-2/h7-8,11-12,14-17H,4-6,9-10,13H2,1-3H3