[2-[4-[(3-propyloxiran-2-yl)methoxy]phenyl]pyrimidin-5-yl] 4-pentylcyclohexane-1-carboxylate

Systemtic Name: [2-[4-[(3-propyloxiran-2-yl)methoxy]phenyl]pyrimidin-5-yl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [2-[4-[(3-propyloxiran-2-yl)methoxy]phenyl]pyrimidin-5-yl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [2-[4-[(3-propyl-2-oxiranyl)methoxy]phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-[(3-propyloxiran-2-yl)methoxy]phenyl]pyrimidin-5-yl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [2-[4-[(3-propyloxiran-2-yl)methoxy]phenyl]pyrimidin-5-yl] ester Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C(=O)OC2=CN=C(N=C2)C3=CC=C(C=C3)OCC4C(O4)CCC

Isomeric SMILES

CCCCCC1CCC(CC1)C(=O)OC2=CN=C(N=C2)C3=CC=C(C=C3)OCC4C(O4)CCC

InChI

InChI=1S/C28H38N2O4/c1-3-5-6-8-20-9-11-22(12-10-20)28(31)33-24-17-29-27(30-18-24)21-13-15-23(16-14-21)32-19-26-25(34-26)7-4-2/h13-18,20,22,25-26H,3-12,19H2,1-2H3