[4-(5-pentoxypyridin-2-yl)phenyl] 4-methylhexanoate

Systemtic Name: [4-(5-pentoxypyridin-2-yl)phenyl] 4-methylhexanoate Openeye Name: [4-(5-pentoxy-2-pyridyl)phenyl] 4-methylhexanoate CAS Name: 4-methylhexanoic acid [4-(5-pentoxy-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-pentoxypyridin-2-yl)phenyl] 4-methylhexanoate Traditional Name: 4-methylhexanoic acid [4-(5-amoxy-2-pyridyl)phenyl] ester Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)CCC(C)CC

Isomeric SMILES

CCCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)CCC(C)CC

InChI

InChI=1S/C23H31NO3/c1-4-6-7-16-26-21-13-14-22(24-17-21)19-9-11-20(12-10-19)27-23(25)15-8-18(3)5-2/h9-14,17-18H,4-8,15-16H2,1-3H3