[4-(5-dodecylpyrimidin-2-yl)phenyl] pentyl carbonate

Systemtic Name: [4-(5-dodecylpyrimidin-2-yl)phenyl] pentyl carbonate Openeye Name: [4-(5-dodecylpyrimidin-2-yl)phenyl] pentyl carbonate CAS Name: carbonic acid [4-(5-dodecyl-2-pyrimidinyl)phenyl] pentyl ester IUPAC Name: [4-(5-dodecylpyrimidin-2-yl)phenyl] pentyl carbonate Traditional Name: carbonic acid amyl [4-(5-laurylpyrimidin-2-yl)phenyl] ester Formula: C28H42N2O3 MolecularWeight: 454.64468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H42N2O3/c1-3-5-7-8-9-10-11-12-13-14-16-24-22-29-27(30-23-24)25-17-19-26(20-18-25)33-28(31)32-21-15-6-4-2/h17-20,22-23H,3-16,21H2,1-2H3