[2,3-bis(fluoranyl)-4-(5-methylpyrimidin-2-yl)phenyl] 4-methylcyclohex-3-ene-1-carboxylate

Systemtic Name: [2,3-bis(fluoranyl)-4-(5-methylpyrimidin-2-yl)phenyl] 4-methylcyclohex-3-ene-1-carboxylate Openeye Name: [2,3-difluoro-4-(5-methylpyrimidin-2-yl)phenyl] 4-methylcyclohex-3-ene-1-carboxylate CAS Name: 4-methyl-1-cyclohex-3-enecarboxylic acid [2,3-difluoro-4-(5-methyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [2,3-difluoro-4-(5-methylpyrimidin-2-yl)phenyl] 4-methylcyclohex-3-ene-1-carboxylate Traditional Name: 4-methylcyclohex-3-ene-1-carboxylic acid [2,3-difluoro-4-(5-methylpyrimidin-2-yl)phenyl] ester Formula: C19H18F2N2O2 MolecularWeight: 344.355226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1)C(=O)OC2=C(C(=C(C=C2)C3=NC=C(C=N3)C)F)F

Isomeric SMILES

CC1=CCC(CC1)C(=O)OC2=C(C(=C(C=C2)C3=NC=C(C=N3)C)F)F

InChI

InChI=1S/C19H18F2N2O2/c1-11-3-5-13(6-4-11)19(24)25-15-8-7-14(16(20)17(15)21)18-22-9-12(2)10-23-18/h3,7-10,13H,4-6H2,1-2H3