[3-acetyloxy-5-(bromomethyl)-2,4-bis(chloranyl)-9-oxidanylidene-xanthen-1-yl] ethanoate

Systemtic Name: [3-acetyloxy-5-(bromomethyl)-2,4-bis(chloranyl)-9-oxidanylidene-xanthen-1-yl] ethanoate Openeye Name: [3-acetoxy-5-(bromomethyl)-2,4-dichloro-9-oxo-xanthen-1-yl] acetate CAS Name: acetic acid [3-acetyloxy-5-(bromomethyl)-2,4-dichloro-9-oxo-1-xanthenyl] ester IUPAC Name: [3-acetyloxy-5-(bromomethyl)-2,4-dichloro-9-oxoxanthen-1-yl] acetate Traditional Name: acetic acid [3-acetoxy-5-(bromomethyl)-2,4-dichloro-9-keto-xanthen-1-yl] ester Formula: C18H11BrCl2O6 MolecularWeight: 474.08634

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C2=C1C(=O)C3=C(O2)C(=CC=C3)CBr)Cl)OC(=O)C)Cl

Isomeric SMILES

CC(=O)OC1=C(C(=C(C2=C1C(=O)C3=C(O2)C(=CC=C3)CBr)Cl)OC(=O)C)Cl

InChI

InChI=1S/C18H11BrCl2O6/c1-7(22)25-16-11-14(24)10-5-3-4-9(6-19)15(10)27-17(11)13(21)18(12(16)20)26-8(2)23/h3-5H,6H2,1-2H3