5-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylamino]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylamino]-2-fluoranyl-benzoic acid Openeye Name: 5-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]-2-fluoro-benzoic acid CAS Name: 5-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]-2-fluorobenzoic acid IUPAC Name: 5-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]-2-fluorobenzoic acid Traditional Name: 5-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]-2-fluoro-benzoic acid Formula: C14H10ClFN2O6S MolecularWeight: 388.755403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC(=C(C=C2)F)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC(=C(C=C2)F)C(=O)O)Cl

InChI

InChI=1S/C14H10ClFN2O6S/c1-7-11(15)5-9(6-13(7)18(21)22)25(23,24)17-8-2-3-12(16)10(4-8)14(19)20/h2-6,17H,1H3,(H,19,20)