[4-(5-decoxypyrimidin-2-yl)phenyl] 4-methylcyclohex-3-ene-1-carboxylate

Systemtic Name: [4-(5-decoxypyrimidin-2-yl)phenyl] 4-methylcyclohex-3-ene-1-carboxylate Openeye Name: [4-(5-decoxypyrimidin-2-yl)phenyl] 4-methylcyclohex-3-ene-1-carboxylate CAS Name: 4-methyl-1-cyclohex-3-enecarboxylic acid [4-(5-decoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-decoxypyrimidin-2-yl)phenyl] 4-methylcyclohex-3-ene-1-carboxylate Traditional Name: 4-methylcyclohex-3-ene-1-carboxylic acid [4-(5-decoxypyrimidin-2-yl)phenyl] ester Formula: C28H38N2O3 MolecularWeight: 450.61292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CCC(=CC3)C

Isomeric SMILES

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CCC(=CC3)C

InChI

InChI=1S/C28H38N2O3/c1-3-4-5-6-7-8-9-10-19-32-26-20-29-27(30-21-26)23-15-17-25(18-16-23)33-28(31)24-13-11-22(2)12-14-24/h11,15-18,20-21,24H,3-10,12-14,19H2,1-2H3