methyl 2-methyl-5-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonyloxymethyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonyloxymethyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[(9,10,10-trioxothioxanthene-3-carbonyl)oxymethyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[oxo-(9,10,10-trioxo-3-thioxanthenyl)methoxy]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(9,10,10-trioxothioxanthene-3-carbonyl)oxymethyl]furan-3-carboxylate Traditional Name: 2-methyl-5-[(9,10,10-triketothioxanthene-3-carbonyl)oxymethyl]furan-3-carboxylic acid methyl ester Formula: C22H16O8S MolecularWeight: 440.42264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)COC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)C(=O)OC

InChI

InChI=1S/C22H16O8S/c1-12-17(22(25)28-2)10-14(30-12)11-29-21(24)13-7-8-16-19(9-13)31(26,27)18-6-4-3-5-15(18)20(16)23/h3-10H,11H2,1-2H3