[(1S)-2-oxidanylidenecyclohexyl] 2-chloranyl-5-sulfamoyl-benzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 2-chloranyl-5-sulfamoyl-benzoate Openeye Name: [(1S)-2-oxocyclohexyl] 2-chloro-5-sulfamoyl-benzoate CAS Name: 2-chloro-5-sulfamoylbenzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 2-chloro-5-sulfamoylbenzoate Traditional Name: 2-chloro-5-sulfamoyl-benzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C13H14ClNO5S MolecularWeight: 331.77196

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Cl

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Cl

InChI

InChI=1S/C13H14ClNO5S/c14-10-6-5-8(21(15,18)19)7-9(10)13(17)20-12-4-2-1-3-11(12)16/h5-7,12H,1-4H2,(H2,15,18,19)/t12-/m0/s1