(5-decyl-2-phenyl-pyrimidin-4-yl) 4-methylcyclohex-3-ene-1-carboxylate

Systemtic Name: (5-decyl-2-phenyl-pyrimidin-4-yl) 4-methylcyclohex-3-ene-1-carboxylate Openeye Name: (5-decyl-2-phenyl-pyrimidin-4-yl) 4-methylcyclohex-3-ene-1-carboxylate CAS Name: 4-methyl-1-cyclohex-3-enecarboxylic acid (5-decyl-2-phenyl-4-pyrimidinyl) ester IUPAC Name: (5-decyl-2-phenylpyrimidin-4-yl) 4-methylcyclohex-3-ene-1-carboxylate Traditional Name: 4-methylcyclohex-3-ene-1-carboxylic acid (5-decyl-2-phenyl-pyrimidin-4-yl) ester Formula: C28H38N2O2 MolecularWeight: 434.61352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1OC(=O)C2CCC(=CC2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1OC(=O)C2CCC(=CC2)C)C3=CC=CC=C3

InChI

InChI=1S/C28H38N2O2/c1-3-4-5-6-7-8-9-11-16-25-21-29-26(23-14-12-10-13-15-23)30-27(25)32-28(31)24-19-17-22(2)18-20-24/h10,12-15,17,21,24H,3-9,11,16,18-20H2,1-2H3