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

Systemtic Name: [2-[4-(4-heptylcyclohexyl)phenyl]pyrimidin-5-yl] heptanoate Openeye Name: [2-[4-(4-heptylcyclohexyl)phenyl]pyrimidin-5-yl] heptanoate CAS Name: heptanoic acid [2-[4-(4-heptylcyclohexyl)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(4-heptylcyclohexyl)phenyl]pyrimidin-5-yl] heptanoate Traditional Name: enanthic acid [2-[4-(4-heptylcyclohexyl)phenyl]pyrimidin-5-yl] ester Formula: C30H44N2O2 MolecularWeight: 464.68256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(=O)CCCCCC

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(=O)CCCCCC

InChI

InChI=1S/C30H44N2O2/c1-3-5-7-9-10-12-24-14-16-25(17-15-24)26-18-20-27(21-19-26)30-31-22-28(23-32-30)34-29(33)13-11-8-6-4-2/h18-25H,3-17H2,1-2H3