[2-(3-pentoxypyridin-4-yl)phenyl] 2-methylbutanoate

Systemtic Name: [2-(3-pentoxypyridin-4-yl)phenyl] 2-methylbutanoate Openeye Name: [2-(3-pentoxy-4-pyridyl)phenyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-(3-pentoxy-4-pyridinyl)phenyl] ester IUPAC Name: [2-(3-pentoxypyridin-4-yl)phenyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-(3-amoxy-4-pyridyl)phenyl] ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CN=C1)C2=CC=CC=C2OC(=O)C(C)CC

Isomeric SMILES

CCCCCOC1=C(C=CN=C1)C2=CC=CC=C2OC(=O)C(C)CC

InChI

InChI=1S/C21H27NO3/c1-4-6-9-14-24-20-15-22-13-12-18(20)17-10-7-8-11-19(17)25-21(23)16(3)5-2/h7-8,10-13,15-16H,4-6,9,14H2,1-3H3