octyl 4-[[4-(5-octylpyrimidin-2-yl)phenoxy]methyl]benzoate

Systemtic Name: octyl 4-[[4-(5-octylpyrimidin-2-yl)phenoxy]methyl]benzoate Openeye Name: octyl 4-[[4-(5-octylpyrimidin-2-yl)phenoxy]methyl]benzoate CAS Name: 4-[[4-(5-octyl-2-pyrimidinyl)phenoxy]methyl]benzoic acid octyl ester IUPAC Name: octyl 4-[[4-(5-octylpyrimidin-2-yl)phenoxy]methyl]benzoate Traditional Name: 4-[[4-(5-octylpyrimidin-2-yl)phenoxy]methyl]benzoic acid octyl ester Formula: C34H46N2O3 MolecularWeight: 530.74064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OCCCCCCCC

InChI

InChI=1S/C34H46N2O3/c1-3-5-7-9-11-13-15-29-25-35-33(36-26-29)30-20-22-32(23-21-30)39-27-28-16-18-31(19-17-28)34(37)38-24-14-12-10-8-6-4-2/h16-23,25-26H,3-15,24,27H2,1-2H3