methyl 4-azanyl-3-chloranyl-5-methylsulfonyloxy-benzoate

Systemtic Name: methyl 4-azanyl-3-chloranyl-5-methylsulfonyloxy-benzoate Openeye Name: methyl 4-amino-3-chloro-5-methylsulfonyloxy-benzoate CAS Name: 4-amino-3-chloro-5-methylsulfonyloxybenzoic acid methyl ester IUPAC Name: methyl 4-amino-3-chloro-5-methylsulfonyloxybenzoate Traditional Name: 4-amino-3-chloro-5-methylsulfonyloxy-benzoic acid methyl ester Formula: C9H10ClNO5S MolecularWeight: 279.6974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)Cl)N)OS(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)Cl)N)OS(=O)(=O)C

InChI

InChI=1S/C9H10ClNO5S/c1-15-9(12)5-3-6(10)8(11)7(4-5)16-17(2,13)14/h3-4H,11H2,1-2H3