methyl 4-iodanyl-2-isocyanatosulfonyl-benzoate

Systemtic Name: methyl 4-iodanyl-2-isocyanatosulfonyl-benzoate Openeye Name: methyl 4-iodo-2-isocyanatosulfonyl-benzoate CAS Name: 4-iodo-2-isocyanatosulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-iodo-2-isocyanatosulfonylbenzoate Traditional Name: 4-iodo-2-isocyanatosulfonyl-benzoic acid methyl ester Formula: C9H6INO5S MolecularWeight: 367.11711

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6INO5S/c1-16-9(13)7-3-2-6(10)4-8(7)17(14,15)11-5-12/h2-4H,1H3