(4-methylphenyl) 4-(5-butan-2-ylpyrimidin-2-yl)benzoate

Systemtic Name: (4-methylphenyl) 4-(5-butan-2-ylpyrimidin-2-yl)benzoate Openeye Name: p-tolyl 4-(5-sec-butylpyrimidin-2-yl)benzoate CAS Name: 4-(5-butan-2-yl-2-pyrimidinyl)benzoic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 4-(5-butan-2-ylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-sec-butylpyrimidin-2-yl)benzoic acid p-tolyl ester Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C

Isomeric SMILES

CCC(C)C1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C

InChI

InChI=1S/C22H22N2O2/c1-4-16(3)19-13-23-21(24-14-19)17-7-9-18(10-8-17)22(25)26-20-11-5-15(2)6-12-20/h5-14,16H,4H2,1-3H3