(1-octanoylpiperidin-4-yl) [4-(2-octylpyrimidin-5-yl)phenyl] carbonate

Systemtic Name: (1-octanoylpiperidin-4-yl) [4-(2-octylpyrimidin-5-yl)phenyl] carbonate Openeye Name: (1-octanoyl-4-piperidyl) [4-(2-octylpyrimidin-5-yl)phenyl] carbonate CAS Name: carbonic acid [4-(2-octyl-5-pyrimidinyl)phenyl] [1-(1-oxooctyl)-4-piperidinyl] ester IUPAC Name: (1-octanoylpiperidin-4-yl) [4-(2-octylpyrimidin-5-yl)phenyl] carbonate Traditional Name: carbonic acid (1-caprylyl-4-piperidyl) [4-(2-octylpyrimidin-5-yl)phenyl] ester Formula: C32H47N3O4 MolecularWeight: 537.73328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NC=C(C=N1)C2=CC=C(C=C2)OC(=O)OC3CCN(CC3)C(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCC1=NC=C(C=N1)C2=CC=C(C=C2)OC(=O)OC3CCN(CC3)C(=O)CCCCCCC

InChI

InChI=1S/C32H47N3O4/c1-3-5-7-9-11-12-14-30-33-24-27(25-34-30)26-16-18-28(19-17-26)38-32(37)39-29-20-22-35(23-21-29)31(36)15-13-10-8-6-4-2/h16-19,24-25,29H,3-15,20-23H2,1-2H3