[2-(2-ethoxypyridin-4-yl)phenyl] 3-methylpentanoate; 2-methyloxane

Systemtic Name: [2-(2-ethoxypyridin-4-yl)phenyl] 3-methylpentanoate; 2-methyloxane Openeye Name: [2-(2-ethoxy-4-pyridyl)phenyl] 3-methylpentanoate; 2-methyltetrahydropyran CAS Name: 2-methyloxane; 3-methylpentanoic acid [2-(2-ethoxy-4-pyridinyl)phenyl] ester IUPAC Name: [2-(2-ethoxypyridin-4-yl)phenyl] 3-methylpentanoate; 2-methyloxane Traditional Name: 2-methyltetrahydropyran; 3-methylvaleric acid [2-(2-ethoxy-4-pyridyl)phenyl] ester Formula: C25H35NO4 MolecularWeight: 413.5497

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)OC1=CC=CC=C1C2=CC(=NC=C2)OCC.CC1CCCCO1

Isomeric SMILES

CCC(C)CC(=O)OC1=CC=CC=C1C2=CC(=NC=C2)OCC.CC1CCCCO1

InChI

InChI=1S/C19H23NO3.C6H12O/c1-4-14(3)12-19(21)23-17-9-7-6-8-16(17)15-10-11-20-18(13-15)22-5-2;1-6-4-2-3-5-7-6/h6-11,13-14H,4-5,12H2,1-3H3;6H,2-5H2,1H3