methyl 4-ethyl-3-isocyanatosulfonyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-ethyl-3-isocyanatosulfonyl-thiophene-2-carboxylate Openeye Name: methyl 4-ethyl-3-isocyanatosulfonyl-thiophene-2-carboxylate CAS Name: 4-ethyl-3-isocyanatosulfonyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-3-isocyanatosulfonylthiophene-2-carboxylate Traditional Name: 4-ethyl-3-isocyanatosulfonyl-thiophene-2-carboxylic acid methyl ester Formula: C9H9NO5S2 MolecularWeight: 275.30146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CSC(=C1S(=O)(=O)N=C=O)C(=O)OC

Isomeric SMILES

CCC1=CSC(=C1S(=O)(=O)N=C=O)C(=O)OC

InChI

InChI=1S/C9H9NO5S2/c1-3-6-4-16-7(9(12)15-2)8(6)17(13,14)10-5-11/h4H,3H2,1-2H3