1-[4-(5-hexoxypyrimidin-2-yl)phenyl]propan-2-yl ethanoate

Systemtic Name: 1-[4-(5-hexoxypyrimidin-2-yl)phenyl]propan-2-yl ethanoate Openeye Name: [2-[4-(5-hexoxypyrimidin-2-yl)phenyl]-1-methyl-ethyl] acetate CAS Name: acetic acid 1-[4-(5-hexoxy-2-pyrimidinyl)phenyl]propan-2-yl ester IUPAC Name: 1-[4-(5-hexoxypyrimidin-2-yl)phenyl]propan-2-yl acetate Traditional Name: acetic acid [2-[4-(5-hexoxypyrimidin-2-yl)phenyl]-1-methyl-ethyl] ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)C

Isomeric SMILES

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)C

InChI

InChI=1S/C21H28N2O3/c1-4-5-6-7-12-25-20-14-22-21(23-15-20)19-10-8-18(9-11-19)13-16(2)26-17(3)24/h8-11,14-16H,4-7,12-13H2,1-3H3