2-methylbutyl 4-[[4-(5-propylpyrimidin-2-yl)phenoxy]methyl]benzoate

Systemtic Name: 2-methylbutyl 4-[[4-(5-propylpyrimidin-2-yl)phenoxy]methyl]benzoate Openeye Name: 2-methylbutyl 4-[[4-(5-propylpyrimidin-2-yl)phenoxy]methyl]benzoate CAS Name: 4-[[4-(5-propyl-2-pyrimidinyl)phenoxy]methyl]benzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 4-[[4-(5-propylpyrimidin-2-yl)phenoxy]methyl]benzoate Traditional Name: 4-[[4-(5-propylpyrimidin-2-yl)phenoxy]methyl]benzoic acid 2-methylbutyl ester Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OCC(C)CC

Isomeric SMILES

CCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OCC(C)CC

InChI

InChI=1S/C26H30N2O3/c1-4-6-21-15-27-25(28-16-21)22-11-13-24(14-12-22)30-18-20-7-9-23(10-8-20)26(29)31-17-19(3)5-2/h7-16,19H,4-6,17-18H2,1-3H3