[4-(5-hexylpyrimidin-2-yl)phenyl] 3-chloranylpropanoate

Systemtic Name: [4-(5-hexylpyrimidin-2-yl)phenyl] 3-chloranylpropanoate Openeye Name: [4-(5-hexylpyrimidin-2-yl)phenyl] 3-chloropropanoate CAS Name: 3-chloropropanoic acid [4-(5-hexyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-hexylpyrimidin-2-yl)phenyl] 3-chloropropanoate Traditional Name: 3-chloropropionic acid [4-(5-hexylpyrimidin-2-yl)phenyl] ester Formula: C19H23ClN2O2 MolecularWeight: 346.85112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23ClN2O2/c1-2-3-4-5-6-15-13-21-19(22-14-15)16-7-9-17(10-8-16)24-18(23)11-12-20/h7-10,13-14H,2-6,11-12H2,1H3