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

Systemtic Name: 4-(furan-2-ylmethylamino)-2-phenoxy-5-sulfamoyl-benzenesulfonic acid Openeye Name: 4-(2-furylmethylamino)-2-phenoxy-5-sulfamoyl-benzenesulfonic acid CAS Name: 4-(2-furanylmethylamino)-2-phenoxy-5-sulfamoylbenzenesulfonic acid IUPAC Name: 4-(furan-2-ylmethylamino)-2-phenoxy-5-sulfamoylbenzenesulfonic acid Traditional Name: 4-(2-furfurylamino)-2-phenoxy-5-sulfamoyl-besylic acid Formula: C17H16N2O7S2 MolecularWeight: 424.44814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C(C(=C2)NCC3=CC=CO3)S(=O)(=O)N)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C(C(=C2)NCC3=CC=CO3)S(=O)(=O)N)S(=O)(=O)O

InChI

InChI=1S/C17H16N2O7S2/c18-27(20,21)16-10-17(28(22,23)24)15(26-12-5-2-1-3-6-12)9-14(16)19-11-13-7-4-8-25-13/h1-10,19H,11H2,(H2,18,20,21)(H,22,23,24)