[2-(4-propylphenyl)pyrimidin-5-yl] 2-fluoranyl-4-hexoxy-benzoate

Systemtic Name: [2-(4-propylphenyl)pyrimidin-5-yl] 2-fluoranyl-4-hexoxy-benzoate Openeye Name: [2-(4-propylphenyl)pyrimidin-5-yl] 2-fluoro-4-hexoxy-benzoate CAS Name: 2-fluoro-4-hexoxybenzoic acid [2-(4-propylphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-propylphenyl)pyrimidin-5-yl] 2-fluoro-4-hexoxybenzoate Traditional Name: 2-fluoro-4-hexoxy-benzoic acid [2-(4-propylphenyl)pyrimidin-5-yl] ester Formula: C26H29FN2O3 MolecularWeight: 436.518463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CN=C(N=C2)C3=CC=C(C=C3)CCC)F

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CN=C(N=C2)C3=CC=C(C=C3)CCC)F

InChI

InChI=1S/C26H29FN2O3/c1-3-5-6-7-15-31-21-13-14-23(24(27)16-21)26(30)32-22-17-28-25(29-18-22)20-11-9-19(8-4-2)10-12-20/h9-14,16-18H,3-8,15H2,1-2H3