oxetan-2-yl 4-bromanyl-3-isocyanatosulfonyl-thiophene-2-carboxylate

Systemtic Name: oxetan-2-yl 4-bromanyl-3-isocyanatosulfonyl-thiophene-2-carboxylate Openeye Name: oxetan-2-yl 4-bromo-3-isocyanatosulfonyl-thiophene-2-carboxylate CAS Name: 4-bromo-3-isocyanatosulfonyl-2-thiophenecarboxylic acid 2-oxetanyl ester IUPAC Name: oxetan-2-yl 4-bromo-3-isocyanatosulfonylthiophene-2-carboxylate Traditional Name: 4-bromo-3-isocyanatosulfonyl-thiophene-2-carboxylic acid oxetan-2-yl ester Formula: C9H6BrNO6S2 MolecularWeight: 368.18104

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Descriptors Computed from Structure

Canonical SMILES:

C1COC1OC(=O)C2=C(C(=CS2)Br)S(=O)(=O)N=C=O

Isomeric SMILES

C1COC1OC(=O)C2=C(C(=CS2)Br)S(=O)(=O)N=C=O

InChI

InChI=1S/C9H6BrNO6S2/c10-5-3-18-7(8(5)19(14,15)11-4-12)9(13)17-6-1-2-16-6/h3,6H,1-2H2