[4-cyclohexyl-2-(4-octoxyphenyl)phenyl] pyrimidin-5-yl carbonate

Systemtic Name: [4-cyclohexyl-2-(4-octoxyphenyl)phenyl] pyrimidin-5-yl carbonate Openeye Name: [4-cyclohexyl-2-(4-octoxyphenyl)phenyl] pyrimidin-5-yl carbonate CAS Name: carbonic acid [4-cyclohexyl-2-(4-octoxyphenyl)phenyl] 5-pyrimidinyl ester IUPAC Name: [4-cyclohexyl-2-(4-octoxyphenyl)phenyl] pyrimidin-5-yl carbonate Traditional Name: carbonic acid [4-cyclohexyl-2-(4-octoxyphenyl)phenyl] 5-pyrimidyl ester Formula: C31H38N2O4 MolecularWeight: 502.64442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=C(C=CC(=C2)C3CCCCC3)OC(=O)OC4=CN=CN=C4

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=C(C=CC(=C2)C3CCCCC3)OC(=O)OC4=CN=CN=C4

InChI

InChI=1S/C31H38N2O4/c1-2-3-4-5-6-10-19-35-27-16-13-25(14-17-27)29-20-26(24-11-8-7-9-12-24)15-18-30(29)37-31(34)36-28-21-32-23-33-22-28/h13-18,20-24H,2-12,19H2,1H3