9-(3-bromanyl-4-cyclopentyloxy-5-ethoxy-phenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione

Systemtic Name: 9-(3-bromanyl-4-cyclopentyloxy-5-ethoxy-phenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Openeye Name: 9-[3-bromo-4-(cyclopentoxy)-5-ethoxy-phenyl]-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione CAS Name: 9-(3-bromo-4-cyclopentyloxy-5-ethoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione IUPAC Name: 9-(3-bromo-4-cyclopentyloxy-5-ethoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Traditional Name: 9-[3-bromo-4-(cyclopentoxy)-5-ethoxy-phenyl]-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-quinone Formula: C26H29BrO5 MolecularWeight: 501.40946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)Br)OC5CCCC5

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)Br)OC5CCCC5

InChI

InChI=1S/C26H29BrO5/c1-2-30-22-14-15(13-17(27)26(22)31-16-7-3-4-8-16)23-24-18(28)9-5-11-20(24)32-21-12-6-10-19(29)25(21)23/h13-14,16,23H,2-12H2,1H3