[4-(5-butoxypyridin-2-yl)phenyl] 2-methylbutanoate

Systemtic Name: [4-(5-butoxypyridin-2-yl)phenyl] 2-methylbutanoate Openeye Name: [4-(5-butoxy-2-pyridyl)phenyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [4-(5-butoxy-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-butoxypyridin-2-yl)phenyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [4-(5-butoxy-2-pyridyl)phenyl] ester Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C(C)CC

Isomeric SMILES

CCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C(C)CC

InChI

InChI=1S/C20H25NO3/c1-4-6-13-23-18-11-12-19(21-14-18)16-7-9-17(10-8-16)24-20(22)15(3)5-2/h7-12,14-15H,4-6,13H2,1-3H3