methyl 3-bromanyl-2-isocyanatosulfonyl-benzoate

Systemtic Name: methyl 3-bromanyl-2-isocyanatosulfonyl-benzoate Openeye Name: methyl 3-bromo-2-isocyanatosulfonyl-benzoate CAS Name: 3-bromo-2-isocyanatosulfonylbenzoic acid methyl ester IUPAC Name: methyl 3-bromo-2-isocyanatosulfonylbenzoate Traditional Name: 3-bromo-2-isocyanatosulfonyl-benzoic acid methyl ester Formula: C9H6BrNO5S MolecularWeight: 320.11664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6BrNO5S/c1-16-9(13)6-3-2-4-7(10)8(6)17(14,15)11-5-12/h2-4H,1H3