(2-bromanyl-4-methyl-phenyl) 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: (2-bromo-4-methyl-phenyl) 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid (2-bromo-4-methyl-phenyl) ester Formula: C12H7Br3O2S MolecularWeight: 454.95978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC(=C(S2)Br)Br)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC(=C(S2)Br)Br)Br

InChI

InChI=1S/C12H7Br3O2S/c1-6-2-3-9(7(13)4-6)17-12(16)10-5-8(14)11(15)18-10/h2-5H,1H3