(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C14H9Br2NO6S MolecularWeight: 479.09736

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC(=C(S3)Br)Br)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC(=C(S3)Br)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H9Br2NO6S/c15-10-3-11(24-13(10)16)14(18)22-5-8-2-9(17(19)20)1-7-4-21-6-23-12(7)8/h1-3H,4-6H2