(4-ethoxycyclohexyl) 4-(5-butylpyrimidin-2-yl)benzoate

Systemtic Name: (4-ethoxycyclohexyl) 4-(5-butylpyrimidin-2-yl)benzoate Openeye Name: (4-ethoxycyclohexyl) 4-(5-butylpyrimidin-2-yl)benzoate CAS Name: 4-(5-butyl-2-pyrimidinyl)benzoic acid (4-ethoxycyclohexyl) ester IUPAC Name: (4-ethoxycyclohexyl) 4-(5-butylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-butylpyrimidin-2-yl)benzoic acid (4-ethoxycyclohexyl) ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)OCC

Isomeric SMILES

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)OCC

InChI

InChI=1S/C23H30N2O3/c1-3-5-6-17-15-24-22(25-16-17)18-7-9-19(10-8-18)23(26)28-21-13-11-20(12-14-21)27-4-2/h7-10,15-16,20-21H,3-6,11-14H2,1-2H3