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

Systemtic Name: [5-(heptoxymethoxy)-4-phenyl-pyrimidin-2-yl] 3-methylpentanoate Openeye Name: [5-(heptoxymethoxy)-4-phenyl-pyrimidin-2-yl] 3-methylpentanoate CAS Name: 3-methylpentanoic acid [5-(heptoxymethoxy)-4-phenyl-2-pyrimidinyl] ester IUPAC Name: [5-(heptoxymethoxy)-4-phenylpyrimidin-2-yl] 3-methylpentanoate Traditional Name: 3-methylvaleric acid [5-(heptoxymethoxy)-4-phenyl-pyrimidin-2-yl] ester Formula: C24H34N2O4 MolecularWeight: 414.53776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCOC1=CN=C(N=C1C2=CC=CC=C2)OC(=O)CC(C)CC

Isomeric SMILES

CCCCCCCOCOC1=CN=C(N=C1C2=CC=CC=C2)OC(=O)CC(C)CC

InChI

InChI=1S/C24H34N2O4/c1-4-6-7-8-12-15-28-18-29-21-17-25-24(30-22(27)16-19(3)5-2)26-23(21)20-13-10-9-11-14-20/h9-11,13-14,17,19H,4-8,12,15-16,18H2,1-3H3