[4-[5-(heptoxymethoxy)pyridin-2-yl]phenyl] 3-methylpentanoate

Systemtic Name: [4-[5-(heptoxymethoxy)pyridin-2-yl]phenyl] 3-methylpentanoate Openeye Name: [4-[5-(heptoxymethoxy)-2-pyridyl]phenyl] 3-methylpentanoate CAS Name: 3-methylpentanoic acid [4-[5-(heptoxymethoxy)-2-pyridinyl]phenyl] ester IUPAC Name: [4-[5-(heptoxymethoxy)pyridin-2-yl]phenyl] 3-methylpentanoate Traditional Name: 3-methylvaleric acid [4-[5-(heptoxymethoxy)-2-pyridyl]phenyl] ester Formula: C25H35NO4 MolecularWeight: 413.5497

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)CC(C)CC

Isomeric SMILES

CCCCCCCOCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)CC(C)CC

InChI

InChI=1S/C25H35NO4/c1-4-6-7-8-9-16-28-19-29-23-14-15-24(26-18-23)21-10-12-22(13-11-21)30-25(27)17-20(3)5-2/h10-15,18,20H,4-9,16-17,19H2,1-3H3