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

Systemtic Name: 1-[4-(5-propylpyrimidin-2-yl)phenyl]propan-2-yl pentanoate Openeye Name: [1-methyl-2-[4-(5-propylpyrimidin-2-yl)phenyl]ethyl] pentanoate CAS Name: pentanoic acid 1-[4-(5-propyl-2-pyrimidinyl)phenyl]propan-2-yl ester IUPAC Name: 1-[4-(5-propylpyrimidin-2-yl)phenyl]propan-2-yl pentanoate Traditional Name: valeric acid [1-methyl-2-[4-(5-propylpyrimidin-2-yl)phenyl]ethyl] ester Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC(C)CC1=CC=C(C=C1)C2=NC=C(C=N2)CCC

Isomeric SMILES

CCCCC(=O)OC(C)CC1=CC=C(C=C1)C2=NC=C(C=N2)CCC

InChI

InChI=1S/C21H28N2O2/c1-4-6-8-20(24)25-16(3)13-17-9-11-19(12-10-17)21-22-14-18(7-5-2)15-23-21/h9-12,14-16H,4-8,13H2,1-3H3