[2-[4-(4-propylcyclohexyl)phenyl]pyrimidin-5-yl] heptanoate

Systemtic Name: [2-[4-(4-propylcyclohexyl)phenyl]pyrimidin-5-yl] heptanoate Openeye Name: [2-[4-(4-propylcyclohexyl)phenyl]pyrimidin-5-yl] heptanoate CAS Name: heptanoic acid [2-[4-(4-propylcyclohexyl)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(4-propylcyclohexyl)phenyl]pyrimidin-5-yl] heptanoate Traditional Name: enanthic acid [2-[4-(4-propylcyclohexyl)phenyl]pyrimidin-5-yl] ester Formula: C26H36N2O2 MolecularWeight: 408.57624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C3CCC(CC3)CCC

Isomeric SMILES

CCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C3CCC(CC3)CCC

InChI

InChI=1S/C26H36N2O2/c1-3-5-6-7-9-25(29)30-24-18-27-26(28-19-24)23-16-14-22(15-17-23)21-12-10-20(8-4-2)11-13-21/h14-21H,3-13H2,1-2H3