[2-bromanyl-4-(1,3-dithiolan-2-yl)-6-methoxy-phenyl] thiophene-2-carboxylate

Systemtic Name: [2-bromanyl-4-(1,3-dithiolan-2-yl)-6-methoxy-phenyl] thiophene-2-carboxylate Openeye Name: [2-bromo-4-(1,3-dithiolan-2-yl)-6-methoxy-phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-bromo-4-(1,3-dithiolan-2-yl)-6-methoxyphenyl] ester IUPAC Name: [2-bromo-4-(1,3-dithiolan-2-yl)-6-methoxyphenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-bromo-4-(1,3-dithiolan-2-yl)-6-methoxy-phenyl] ester Formula: C15H13BrO3S3 MolecularWeight: 417.36092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2SCCS2)Br)OC(=O)C3=CC=CS3

Isomeric SMILES

COC1=C(C(=CC(=C1)C2SCCS2)Br)OC(=O)C3=CC=CS3

InChI

InChI=1S/C15H13BrO3S3/c1-18-11-8-9(15-21-5-6-22-15)7-10(16)13(11)19-14(17)12-3-2-4-20-12/h2-4,7-8,15H,5-6H2,1H3