4-(cyclopentylmethylsulfonyl)-2-(furan-2-ylmethylamino)-5-sulfamoyl-benzenesulfonic acid

Systemtic Name: 4-(cyclopentylmethylsulfonyl)-2-(furan-2-ylmethylamino)-5-sulfamoyl-benzenesulfonic acid Openeye Name: 4-(cyclopentylmethylsulfonyl)-2-(2-furylmethylamino)-5-sulfamoyl-benzenesulfonic acid CAS Name: 4-(cyclopentylmethylsulfonyl)-2-(2-furanylmethylamino)-5-sulfamoylbenzenesulfonic acid IUPAC Name: 4-(cyclopentylmethylsulfonyl)-2-(furan-2-ylmethylamino)-5-sulfamoylbenzenesulfonic acid Traditional Name: 4-(cyclopentylmethylsulfonyl)-2-(2-furfurylamino)-5-sulfamoyl-besylic acid Formula: C17H22N2O8S3 MolecularWeight: 478.56018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CS(=O)(=O)C2=C(C=C(C(=C2)NCC3=CC=CO3)S(=O)(=O)O)S(=O)(=O)N

Isomeric SMILES

C1CCC(C1)CS(=O)(=O)C2=C(C=C(C(=C2)NCC3=CC=CO3)S(=O)(=O)O)S(=O)(=O)N

InChI

InChI=1S/C17H22N2O8S3/c18-29(22,23)17-9-15(30(24,25)26)14(19-10-13-6-3-7-27-13)8-16(17)28(20,21)11-12-4-1-2-5-12/h3,6-9,12,19H,1-2,4-5,10-11H2,(H2,18,22,23)(H,24,25,26)