diethyl 3-bromanyl-6,11-bis(oxidanylidene)benzo[b]thioxanthene-12,12-dicarboxylate

Systemtic Name: diethyl 3-bromanyl-6,11-bis(oxidanylidene)benzo[b]thioxanthene-12,12-dicarboxylate Openeye Name: diethyl 3-bromo-6,11-dioxo-benzo[b]thioxanthene-12,12-dicarboxylate CAS Name: 3-bromo-6,11-dioxobenzo[b]thioxanthene-12,12-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-bromo-6,11-dioxobenzo[b]thioxanthene-12,12-dicarboxylate Traditional Name: 3-bromo-6,11-diketo-benzo[b]thioxanthene-12,12-dicarboxylic acid diethyl ester Formula: C23H17BrO6S MolecularWeight: 501.34648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2=C(C=C(C=C2)Br)SC3=C1C(=O)C4=CC=CC=C4C3=O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(C2=C(C=C(C=C2)Br)SC3=C1C(=O)C4=CC=CC=C4C3=O)C(=O)OCC

InChI

InChI=1S/C23H17BrO6S/c1-3-29-21(27)23(22(28)30-4-2)15-10-9-12(24)11-16(15)31-20-17(23)18(25)13-7-5-6-8-14(13)19(20)26/h5-11H,3-4H2,1-2H3