methyl 2-[2,7-bis(bromanyl)-5-ethyl-3,6-dimethoxy-9,9-dimethyl-xanthen-4-yl]ethanoate

Systemtic Name: methyl 2-[2,7-bis(bromanyl)-5-ethyl-3,6-dimethoxy-9,9-dimethyl-xanthen-4-yl]ethanoate Openeye Name: methyl 2-(2,7-dibromo-5-ethyl-3,6-dimethoxy-9,9-dimethyl-xanthen-4-yl)acetate CAS Name: 2-(2,7-dibromo-5-ethyl-3,6-dimethoxy-9,9-dimethyl-4-xanthenyl)acetic acid methyl ester IUPAC Name: methyl 2-(2,7-dibromo-5-ethyl-3,6-dimethoxy-9,9-dimethylxanthen-4-yl)acetate Traditional Name: 2-(2,7-dibromo-5-ethyl-3,6-dimethoxy-9,9-dimethyl-xanthen-4-yl)acetic acid methyl ester Formula: C22H24Br2O5 MolecularWeight: 528.23096

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1OC)Br)C(C3=CC(=C(C(=C3O2)CC(=O)OC)OC)Br)(C)C

Isomeric SMILES

CCC1=C2C(=CC(=C1OC)Br)C(C3=CC(=C(C(=C3O2)CC(=O)OC)OC)Br)(C)C

InChI

InChI=1S/C22H24Br2O5/c1-7-11-18-13(9-15(23)20(11)27-5)22(2,3)14-10-16(24)21(28-6)12(19(14)29-18)8-17(25)26-4/h9-10H,7-8H2,1-6H3