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

Systemtic Name: octyl 4-[[4-(5-butylpyrimidin-2-yl)phenoxy]methyl]benzoate Openeye Name: octyl 4-[[4-(5-butylpyrimidin-2-yl)phenoxy]methyl]benzoate CAS Name: 4-[[4-(5-butyl-2-pyrimidinyl)phenoxy]methyl]benzoic acid octyl ester IUPAC Name: octyl 4-[[4-(5-butylpyrimidin-2-yl)phenoxy]methyl]benzoate Traditional Name: 4-[[4-(5-butylpyrimidin-2-yl)phenoxy]methyl]benzoic acid octyl ester Formula: C30H38N2O3 MolecularWeight: 474.63432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCCC

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCCC

InChI

InChI=1S/C30H38N2O3/c1-3-5-7-8-9-10-20-34-30(33)27-14-12-24(13-15-27)23-35-28-18-16-26(17-19-28)29-31-21-25(22-32-29)11-6-4-2/h12-19,21-22H,3-11,20,23H2,1-2H3