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

Systemtic Name: [4-(5-nonoxypyridin-2-yl)phenyl] 4-methylhexanoate Openeye Name: [4-(5-nonoxy-2-pyridyl)phenyl] 4-methylhexanoate CAS Name: 4-methylhexanoic acid [4-(5-nonoxy-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-nonoxypyridin-2-yl)phenyl] 4-methylhexanoate Traditional Name: 4-methylhexanoic acid [4-(5-nonoxy-2-pyridyl)phenyl] ester Formula: C27H39NO3 MolecularWeight: 425.60346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)CCC(C)CC

Isomeric SMILES

CCCCCCCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)CCC(C)CC

InChI

InChI=1S/C27H39NO3/c1-4-6-7-8-9-10-11-20-30-25-17-18-26(28-21-25)23-13-15-24(16-14-23)31-27(29)19-12-22(3)5-2/h13-18,21-22H,4-12,19-20H2,1-3H3