4-chloranyl-2-[cyclohexylcarbonyl(furan-2-ylmethyl)amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 4-chloranyl-2-[cyclohexylcarbonyl(furan-2-ylmethyl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 4-chloro-2-[cyclohexanecarbonyl(2-furylmethyl)amino]-5-sulfamoyl-benzoic acid CAS Name: 4-chloro-2-[[cyclohexyl(oxo)methyl]-(2-furanylmethyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 4-chloro-2-[cyclohexanecarbonyl(furan-2-ylmethyl)amino]-5-sulfamoylbenzoic acid Traditional Name: 4-chloro-2-[cyclohexanecarbonyl(2-furfuryl)amino]-5-sulfamoyl-benzoic acid Formula: C19H21ClN2O6S MolecularWeight: 440.89784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2=CC=CO2)C3=CC(=C(C=C3C(=O)O)S(=O)(=O)N)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2=CC=CO2)C3=CC(=C(C=C3C(=O)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C19H21ClN2O6S/c20-15-10-16(14(19(24)25)9-17(15)29(21,26)27)22(11-13-7-4-8-28-13)18(23)12-5-2-1-3-6-12/h4,7-10,12H,1-3,5-6,11H2,(H,24,25)(H2,21,26,27)