[4-(5-dodecylpyrimidin-2-yl)phenyl] 2,2-dimethylcyclopropane-1-carboxylate

Systemtic Name: [4-(5-dodecylpyrimidin-2-yl)phenyl] 2,2-dimethylcyclopropane-1-carboxylate Openeye Name: [4-(5-dodecylpyrimidin-2-yl)phenyl] 2,2-dimethylcyclopropanecarboxylate CAS Name: 2,2-dimethyl-1-cyclopropanecarboxylic acid [4-(5-dodecyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-dodecylpyrimidin-2-yl)phenyl] 2,2-dimethylcyclopropane-1-carboxylate Traditional Name: 2,2-dimethylcyclopropanecarboxylic acid [4-(5-laurylpyrimidin-2-yl)phenyl] ester Formula: C28H40N2O2 MolecularWeight: 436.6294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CC3(C)C

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CC3(C)C

InChI

InChI=1S/C28H40N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-22-20-29-26(30-21-22)23-15-17-24(18-16-23)32-27(31)25-19-28(25,2)3/h15-18,20-21,25H,4-14,19H2,1-3H3