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

Systemtic Name: [2-(3-hexoxypyridin-4-yl)phenyl] 3-methylpentanoate Openeye Name: [2-(3-hexoxy-4-pyridyl)phenyl] 3-methylpentanoate CAS Name: 3-methylpentanoic acid [2-(3-hexoxy-4-pyridinyl)phenyl] ester IUPAC Name: [2-(3-hexoxypyridin-4-yl)phenyl] 3-methylpentanoate Traditional Name: 3-methylvaleric acid [2-(3-hexoxy-4-pyridyl)phenyl] ester Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO3/c1-4-6-7-10-15-26-22-17-24-14-13-20(22)19-11-8-9-12-21(19)27-23(25)16-18(3)5-2/h8-9,11-14,17-18H,4-7,10,15-16H2,1-3H3