9-(5-bromanylthiophen-2-yl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione

Systemtic Name: 9-(5-bromanylthiophen-2-yl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Openeye Name: 9-(5-bromo-2-thienyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione CAS Name: 9-(5-bromo-2-thiophenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione IUPAC Name: 9-(5-bromothiophen-2-yl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Traditional Name: 9-(5-bromo-2-thienyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-quinone Formula: C17H15BrO3S MolecularWeight: 379.2682

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C3=C(O2)CCCC3=O)C4=CC=C(S4)Br)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C3=C(O2)CCCC3=O)C4=CC=C(S4)Br)C(=O)C1

InChI

InChI=1S/C17H15BrO3S/c18-14-8-7-13(22-14)17-15-9(19)3-1-5-11(15)21-12-6-2-4-10(20)16(12)17/h7-8,17H,1-6H2