dimethyl 2-(2-bromanyl-9-propan-2-ylidene-thioxanthen-10-ylidene)propanedioate

Systemtic Name: dimethyl 2-(2-bromanyl-9-propan-2-ylidene-thioxanthen-10-ylidene)propanedioate Openeye Name: dimethyl 2-(2-bromo-9-isopropylidene-thioxanthen-10-ylidene)propanedioate CAS Name: 2-(2-bromo-9-propan-2-ylidene-10-thioxanthenylidene)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2-bromo-9-propan-2-ylidenethioxanthen-10-ylidene)propanedioate Traditional Name: 2-(2-bromo-9-isopropylidene-thioxanthen-10-ylidene)malonic acid dimethyl ester Formula: C21H19BrO4S MolecularWeight: 447.34216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C2=CC=CC=C2S(=C(C(=O)OC)C(=O)OC)C3=C1C=C(C=C3)Br)C

Isomeric SMILES

CC(=C1C2=CC=CC=C2S(=C(C(=O)OC)C(=O)OC)C3=C1C=C(C=C3)Br)C

InChI

InChI=1S/C21H19BrO4S/c1-12(2)18-14-7-5-6-8-16(14)27(17-10-9-13(22)11-15(17)18)19(20(23)25-3)21(24)26-4/h5-11H,1-4H3