[4-(2-ethoxypyrimidin-5-yl)phenyl] 2-chloranyl-3-methyl-pentanoate

Systemtic Name: [4-(2-ethoxypyrimidin-5-yl)phenyl] 2-chloranyl-3-methyl-pentanoate Openeye Name: [4-(2-ethoxypyrimidin-5-yl)phenyl] 2-chloro-3-methyl-pentanoate CAS Name: 2-chloro-3-methylpentanoic acid [4-(2-ethoxy-5-pyrimidinyl)phenyl] ester IUPAC Name: [4-(2-ethoxypyrimidin-5-yl)phenyl] 2-chloro-3-methylpentanoate Traditional Name: 2-chloro-3-methyl-valeric acid [4-(2-ethoxypyrimidin-5-yl)phenyl] ester Formula: C18H21ClN2O3 MolecularWeight: 348.82394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC1=CC=C(C=C1)C2=CN=C(N=C2)OCC)Cl

Isomeric SMILES

CCC(C)C(C(=O)OC1=CC=C(C=C1)C2=CN=C(N=C2)OCC)Cl

InChI

InChI=1S/C18H21ClN2O3/c1-4-12(3)16(19)17(22)24-15-8-6-13(7-9-15)14-10-20-18(21-11-14)23-5-2/h6-12,16H,4-5H2,1-3H3