(7-chloranyl-1,3-benzodioxol-5-yl)methyl 5-nitrothiophene-2-carboxylate

Systemtic Name: (7-chloranyl-1,3-benzodioxol-5-yl)methyl 5-nitrothiophene-2-carboxylate Openeye Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester Formula: C13H8ClNO6S MolecularWeight: 341.72372

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)COC(=O)C3=CC=C(S3)[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)COC(=O)C3=CC=C(S3)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H8ClNO6S/c14-8-3-7(4-9-12(8)21-6-20-9)5-19-13(16)10-1-2-11(22-10)15(17)18/h1-4H,5-6H2