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

Systemtic Name: 4-chloranyl-2-[furan-2-ylmethyl(2-oxidanylethanoyl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 4-chloro-2-[2-furylmethyl-(2-hydroxyacetyl)amino]-5-sulfamoyl-benzoic acid CAS Name: 4-chloro-2-[2-furanylmethyl-(2-hydroxy-1-oxoethyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 4-chloro-2-[furan-2-ylmethyl-(2-hydroxyacetyl)amino]-5-sulfamoylbenzoic acid Traditional Name: 4-chloro-2-[2-furfuryl(glycoloyl)amino]-5-sulfamoyl-benzoic acid Formula: C14H13ClN2O7S MolecularWeight: 388.78022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(C2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl)C(=O)CO

Isomeric SMILES

C1=COC(=C1)CN(C2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl)C(=O)CO

InChI

InChI=1S/C14H13ClN2O7S/c15-10-5-11(9(14(20)21)4-12(10)25(16,22)23)17(13(19)7-18)6-8-2-1-3-24-8/h1-5,18H,6-7H2,(H,20,21)(H2,16,22,23)