[2-[5-(9-cyclopropylnonoxy)pyrimidin-2-yl]phenyl] 4-pentylcyclohexane-1-carboxylate

Systemtic Name: [2-[5-(9-cyclopropylnonoxy)pyrimidin-2-yl]phenyl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [2-[5-(9-cyclopropylnonoxy)pyrimidin-2-yl]phenyl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [2-[5-(9-cyclopropylnonoxy)-2-pyrimidinyl]phenyl] ester IUPAC Name: [2-[5-(9-cyclopropylnonoxy)pyrimidin-2-yl]phenyl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [2-[5-(9-cyclopropylnonoxy)pyrimidin-2-yl]phenyl] ester Formula: C34H50N2O3 MolecularWeight: 534.7724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C(=O)OC2=CC=CC=C2C3=NC=C(C=N3)OCCCCCCCCCC4CC4

Isomeric SMILES

CCCCCC1CCC(CC1)C(=O)OC2=CC=CC=C2C3=NC=C(C=N3)OCCCCCCCCCC4CC4

InChI

InChI=1S/C34H50N2O3/c1-2-3-9-14-28-20-22-29(23-21-28)34(37)39-32-17-12-11-16-31(32)33-35-25-30(26-36-33)38-24-13-8-6-4-5-7-10-15-27-18-19-27/h11-12,16-17,25-29H,2-10,13-15,18-24H2,1H3