dodecyl 2,5-bis(bromanyl)thiophene-3-carboxylate

Systemtic Name: dodecyl 2,5-bis(bromanyl)thiophene-3-carboxylate Openeye Name: dodecyl 2,5-dibromothiophene-3-carboxylate CAS Name: 2,5-dibromo-3-thiophenecarboxylic acid dodecyl ester IUPAC Name: dodecyl 2,5-dibromothiophene-3-carboxylate Traditional Name: 2,5-dibromothiophene-3-carboxylic acid lauryl ester Formula: C17H26Br2O2S MolecularWeight: 454.26014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=C(SC(=C1)Br)Br

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=C(SC(=C1)Br)Br

InChI

InChI=1S/C17H26Br2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-21-17(20)14-13-15(18)22-16(14)19/h13H,2-12H2,1H3