(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 5-bromanylthiophene-2-carboxylate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 5-bromanylthiophene-2-carboxylate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C14H10BrClO4S MolecularWeight: 389.6488

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C14H10BrClO4S/c15-12-2-1-11(21-12)14(17)20-7-8-5-9(16)13-10(6-8)18-3-4-19-13/h1-2,5-6H,3-4,7H2