[4,5-diacetyloxy-6-[2-bromanyl-5,6,7-tris(fluoranyl)benzimidazol-1-yl]oxan-3-yl] ethanoate

Systemtic Name: [4,5-diacetyloxy-6-[2-bromanyl-5,6,7-tris(fluoranyl)benzimidazol-1-yl]oxan-3-yl] ethanoate Openeye Name: [4,5-diacetoxy-6-(2-bromo-5,6,7-trifluoro-benzimidazol-1-yl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [4,5-diacetyloxy-6-(2-bromo-5,6,7-trifluoro-1-benzimidazolyl)-3-oxanyl] ester IUPAC Name: [4,5-diacetyloxy-6-(2-bromo-5,6,7-trifluorobenzimidazol-1-yl)oxan-3-yl] acetate Traditional Name: acetic acid [4,5-diacetoxy-6-(2-bromo-5,6,7-trifluoro-benzimidazol-1-yl)tetrahydropyran-3-yl] ester Formula: C18H16BrF3N2O7 MolecularWeight: 509.22805

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)N2C3=C(C(=C(C=C3N=C2Br)F)F)F

Isomeric SMILES

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)N2C3=C(C(=C(C=C3N=C2Br)F)F)F

InChI

InChI=1S/C18H16BrF3N2O7/c1-6(25)29-11-5-28-17(16(31-8(3)27)15(11)30-7(2)26)24-14-10(23-18(24)19)4-9(20)12(21)13(14)22/h4,11,15-17H,5H2,1-3H3