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

Systemtic Name: [4-(5-heptoxypyrimidin-2-yl)phenyl] 4-methylhexanoate Openeye Name: [4-(5-heptoxypyrimidin-2-yl)phenyl] 4-methylhexanoate CAS Name: 4-methylhexanoic acid [4-(5-heptoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-heptoxypyrimidin-2-yl)phenyl] 4-methylhexanoate Traditional Name: 4-methylhexanoic acid [4-(5-heptoxypyrimidin-2-yl)phenyl] ester Formula: C24H34N2O3 MolecularWeight: 398.53836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCC(C)CC

Isomeric SMILES

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCC(C)CC

InChI

InChI=1S/C24H34N2O3/c1-4-6-7-8-9-16-28-22-17-25-24(26-18-22)20-11-13-21(14-12-20)29-23(27)15-10-19(3)5-2/h11-14,17-19H,4-10,15-16H2,1-3H3