(4-ethylcyclohexyl) 4-(5-propylpyrimidin-2-yl)benzoate

Systemtic Name: (4-ethylcyclohexyl) 4-(5-propylpyrimidin-2-yl)benzoate Openeye Name: (4-ethylcyclohexyl) 4-(5-propylpyrimidin-2-yl)benzoate CAS Name: 4-(5-propyl-2-pyrimidinyl)benzoic acid (4-ethylcyclohexyl) ester IUPAC Name: (4-ethylcyclohexyl) 4-(5-propylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-propylpyrimidin-2-yl)benzoic acid (4-ethylcyclohexyl) ester Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CC

Isomeric SMILES

CCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CC

InChI

InChI=1S/C22H28N2O2/c1-3-5-17-14-23-21(24-15-17)18-8-10-19(11-9-18)22(25)26-20-12-6-16(4-2)7-13-20/h8-11,14-16,20H,3-7,12-13H2,1-2H3