methyl 4-isocyanato-2-isocyanatosulfonyl-benzoate

Systemtic Name: methyl 4-isocyanato-2-isocyanatosulfonyl-benzoate Openeye Name: methyl 4-isocyanato-2-isocyanatosulfonyl-benzoate CAS Name: 4-isocyanato-2-isocyanatosulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-isocyanato-2-isocyanatosulfonylbenzoate Traditional Name: 4-isocyanato-2-isocyanatosulfonyl-benzoic acid methyl ester Formula: C10H6N2O6S MolecularWeight: 282.22944

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)N=C=O)S(=O)(=O)N=C=O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)N=C=O)S(=O)(=O)N=C=O

InChI

InChI=1S/C10H6N2O6S/c1-18-10(15)8-3-2-7(11-5-13)4-9(8)19(16,17)12-6-14/h2-4H,1H3