[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-2-oxidanyl-benzoate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-2-oxidanyl-benzoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 4-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-hydroxy-benzoate CAS Name: 4-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-hydroxybenzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 4-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-hydroxybenzoate Traditional Name: 4-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-hydroxy-benzoic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C20H16ClN3O9S MolecularWeight: 509.87374

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)COC(=O)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])O

Isomeric SMILES

C1=COC(=C1)CNC(=O)COC(=O)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])O

InChI

InChI=1S/C20H16ClN3O9S/c21-16-6-4-14(9-17(16)24(28)29)34(30,31)23-12-3-5-15(18(25)8-12)20(27)33-11-19(26)22-10-13-2-1-7-32-13/h1-9,23,25H,10-11H2,(H,22,26)