1-[4-(5-hexylpyrimidin-2-yl)phenyl]propan-2-yl pentanoate

Systemtic Name: 1-[4-(5-hexylpyrimidin-2-yl)phenyl]propan-2-yl pentanoate Openeye Name: [2-[4-(5-hexylpyrimidin-2-yl)phenyl]-1-methyl-ethyl] pentanoate CAS Name: pentanoic acid 1-[4-(5-hexyl-2-pyrimidinyl)phenyl]propan-2-yl ester IUPAC Name: 1-[4-(5-hexylpyrimidin-2-yl)phenyl]propan-2-yl pentanoate Traditional Name: valeric acid [2-[4-(5-hexylpyrimidin-2-yl)phenyl]-1-methyl-ethyl] ester Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCCC

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCCC

InChI

InChI=1S/C24H34N2O2/c1-4-6-8-9-10-21-17-25-24(26-18-21)22-14-12-20(13-15-22)16-19(3)28-23(27)11-7-5-2/h12-15,17-19H,4-11,16H2,1-3H3