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

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl thiophene-2-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C14H11NO6S MolecularWeight: 321.30524

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO6S/c16-14(12-2-1-3-22-12)20-7-10-5-11(15(17)18)4-9-6-19-8-21-13(9)10/h1-5H,6-8H2