2-chloranyl-4-(furan-2-ylmethylamino)-5-methoxycarbonyl-benzenesulfonimidic acid

Systemtic Name: 2-chloranyl-4-(furan-2-ylmethylamino)-5-methoxycarbonyl-benzenesulfonimidic acid Openeye Name: 2-chloro-4-(2-furylmethylamino)-5-methoxycarbonyl-benzenesulfonimidic acid CAS Name: 2-chloro-4-(2-furanylmethylamino)-5-methoxycarbonylbenzenesulfonimidic acid IUPAC Name: 2-chloro-4-(furan-2-ylmethylamino)-5-methoxycarbonylbenzenesulfonimidic acid Traditional Name: 5-carbomethoxy-2-chloro-4-(2-furfurylamino)benzenesulfonimidic acid Formula: C13H13ClN2O5S MolecularWeight: 344.77072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1NCC2=CC=CO2)Cl)S(=N)(=O)O

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1NCC2=CC=CO2)Cl)S(=N)(=O)O

InChI

InChI=1S/C13H13ClN2O5S/c1-20-13(17)9-5-12(22(15,18)19)10(14)6-11(9)16-7-8-3-2-4-21-8/h2-6,16H,7H2,1H3,(H2,15,18,19)