[2-(3-hexoxypyridin-4-yl)phenyl] 4-methylhexanoate

Systemtic Name: [2-(3-hexoxypyridin-4-yl)phenyl] 4-methylhexanoate Openeye Name: [2-(3-hexoxy-4-pyridyl)phenyl] 4-methylhexanoate CAS Name: 4-methylhexanoic acid [2-(3-hexoxy-4-pyridinyl)phenyl] ester IUPAC Name: [2-(3-hexoxypyridin-4-yl)phenyl] 4-methylhexanoate Traditional Name: 4-methylhexanoic acid [2-(3-hexoxy-4-pyridyl)phenyl] ester Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=CN=C1)C2=CC=CC=C2OC(=O)CCC(C)CC

Isomeric SMILES

CCCCCCOC1=C(C=CN=C1)C2=CC=CC=C2OC(=O)CCC(C)CC

InChI

InChI=1S/C24H33NO3/c1-4-6-7-10-17-27-23-18-25-16-15-21(23)20-11-8-9-12-22(20)28-24(26)14-13-19(3)5-2/h8-9,11-12,15-16,18-19H,4-7,10,13-14,17H2,1-3H3