[4-[5-(4-decylphenyl)pyrimidin-2-yl]phenyl] 2-methylcyclohexane-1-carboxylate

Systemtic Name: [4-[5-(4-decylphenyl)pyrimidin-2-yl]phenyl] 2-methylcyclohexane-1-carboxylate Openeye Name: [4-[5-(4-decylphenyl)pyrimidin-2-yl]phenyl] 2-methylcyclohexanecarboxylate CAS Name: 2-methyl-1-cyclohexanecarboxylic acid [4-[5-(4-decylphenyl)-2-pyrimidinyl]phenyl] ester IUPAC Name: [4-[5-(4-decylphenyl)pyrimidin-2-yl]phenyl] 2-methylcyclohexane-1-carboxylate Traditional Name: 2-methylcyclohexanecarboxylic acid [4-[5-(4-decylphenyl)pyrimidin-2-yl]phenyl] ester Formula: C34H44N2O2 MolecularWeight: 512.72536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OC(=O)C4CCCCC4C

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OC(=O)C4CCCCC4C

InChI

InChI=1S/C34H44N2O2/c1-3-4-5-6-7-8-9-10-14-27-16-18-28(19-17-27)30-24-35-33(36-25-30)29-20-22-31(23-21-29)38-34(37)32-15-12-11-13-26(32)2/h16-26,32H,3-15H2,1-2H3