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

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 2-chloranyl-5-[phenyl(prop-2-enyl)sulfamoyl]benzoate Openeye Name: [(1S)-2-oxocyclohexyl] 5-[allyl(phenyl)sulfamoyl]-2-chloro-benzoate CAS Name: 2-chloro-5-[phenyl(prop-2-enyl)sulfamoyl]benzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 2-chloro-5-[phenyl(prop-2-enyl)sulfamoyl]benzoate Traditional Name: 5-[allyl(phenyl)sulfamoyl]-2-chloro-benzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C22H22ClNO5S MolecularWeight: 447.93178

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OC3CCCCC3=O

Isomeric SMILES

C=CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O[C@H]3CCCCC3=O

InChI

InChI=1S/C22H22ClNO5S/c1-2-14-24(16-8-4-3-5-9-16)30(27,28)17-12-13-19(23)18(15-17)22(26)29-21-11-7-6-10-20(21)25/h2-5,8-9,12-13,15,21H,1,6-7,10-11,14H2/t21-/m0/s1