4-chloranyl-2-[furan-2-ylmethyl-(3-nitrophenyl)carbonyl-amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 4-chloranyl-2-[furan-2-ylmethyl-(3-nitrophenyl)carbonyl-amino]-5-sulfamoyl-benzoic acid Openeye Name: 4-chloro-2-[2-furylmethyl-(3-nitrobenzoyl)amino]-5-sulfamoyl-benzoic acid CAS Name: 4-chloro-2-[2-furanylmethyl-[(3-nitrophenyl)-oxomethyl]amino]-5-sulfamoylbenzoic acid IUPAC Name: 4-chloro-2-[furan-2-ylmethyl-(3-nitrobenzoyl)amino]-5-sulfamoylbenzoic acid Traditional Name: 4-chloro-2-[2-furfuryl-(3-nitrobenzoyl)amino]-5-sulfamoyl-benzoic acid Formula: C19H14ClN3O8S MolecularWeight: 479.84776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N(CC2=CC=CO2)C3=CC(=C(C=C3C(=O)O)S(=O)(=O)N)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N(CC2=CC=CO2)C3=CC(=C(C=C3C(=O)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C19H14ClN3O8S/c20-15-9-16(14(19(25)26)8-17(15)32(21,29)30)22(10-13-5-2-6-31-13)18(24)11-3-1-4-12(7-11)23(27)28/h1-9H,10H2,(H,25,26)(H2,21,29,30)