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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C(=O)OC2=NC=NC=C2C3=CC=CC=C3OCC4C(O4)CCC

Isomeric SMILES

CCCCCC1CCC(CC1)C(=O)OC2=NC=NC=C2C3=CC=CC=C3OCC4C(O4)CCC

InChI

InChI=1S/C28H38N2O4/c1-3-5-6-10-20-13-15-21(16-14-20)28(31)34-27-23(17-29-19-30-27)22-11-7-8-12-24(22)32-18-26-25(33-26)9-4-2/h7-8,11-12,17,19-21,25-26H,3-6,9-10,13-16,18H2,1-2H3