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(5-octyl-2-phenyl-pyrimidin-4-yl) 4-(2-methylbutoxy)benzoate

(5-octyl-2-phenyl-pyrimidin-4-yl) 4-(2-methylbutoxy)benzoate

Systemtic Name:(5-octyl-2-phenyl-pyrimidin-4-yl) 4-(2-methylbutoxy)benzoate
Openeye Name:(5-octyl-2-phenyl-pyrimidin-4-yl) 4-(2-methylbutoxy)benzoate
CAS Name:4-(2-methylbutoxy)benzoic acid (5-octyl-2-phenyl-4-pyrimidinyl) ester
IUPAC Name:(5-octyl-2-phenylpyrimidin-4-yl) 4-(2-methylbutoxy)benzoate
Traditional Name:4-(2-methylbutoxy)benzoic acid (5-octyl-2-phenyl-pyrimidin-4-yl) ester
Formula: C30H38N2O3
MolecularWeight: 474.63432
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1OC(=O)C2=CC=C(C=C2)OCC(C)CC)C3=CC=CC=C3


Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1OC(=O)C2=CC=C(C=C2)OCC(C)CC)C3=CC=CC=C3


InChI

InChI=1S/C30H38N2O3/c1-4-6-7-8-9-11-16-26-21-31-28(24-14-12-10-13-15-24)32-29(26)35-30(33)25-17-19-27(20-18-25)34-22-23(3)5-2/h10,12-15,17-21,23H,4-9,11,16,22H2,1-3H3


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