hexyl 4-(5-pentylpyrimidin-2-yl)benzoate

Systemtic Name: hexyl 4-(5-pentylpyrimidin-2-yl)benzoate Openeye Name: hexyl 4-(5-pentylpyrimidin-2-yl)benzoate CAS Name: 4-(5-pentyl-2-pyrimidinyl)benzoic acid hexyl ester IUPAC Name: hexyl 4-(5-pentylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-amylpyrimidin-2-yl)benzoic acid hexyl ester Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)C2=NC=C(C=N2)CCCCC

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)C2=NC=C(C=N2)CCCCC

InChI

InChI=1S/C22H30N2O2/c1-3-5-7-9-15-26-22(25)20-13-11-19(12-14-20)21-23-16-18(17-24-21)10-8-6-4-2/h11-14,16-17H,3-10,15H2,1-2H3