3-chloranyl-5-(cyclohexylcarbamoylamino)benzenesulfonic acid

Systemtic Name: 3-chloranyl-5-(cyclohexylcarbamoylamino)benzenesulfonic acid Openeye Name: 3-chloro-5-(cyclohexylcarbamoylamino)benzenesulfonic acid CAS Name: 3-chloro-5-[[(cyclohexylamino)-oxomethyl]amino]benzenesulfonic acid IUPAC Name: 3-chloro-5-(cyclohexylcarbamoylamino)benzenesulfonic acid Traditional Name: 3-chloro-5-(cyclohexylcarbamoylamino)besylic acid Formula: C13H17ClN2O4S MolecularWeight: 332.80308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=CC(=CC(=C2)Cl)S(=O)(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=CC(=CC(=C2)Cl)S(=O)(=O)O

InChI

InChI=1S/C13H17ClN2O4S/c14-9-6-11(8-12(7-9)21(18,19)20)16-13(17)15-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H2,15,16,17)(H,18,19,20)