3-[3-(2-chloranyl-4-nitro-phenoxy)propylcarbamoylamino]benzenesulfonyl fluoride

Systemtic Name: 3-[3-(2-chloranyl-4-nitro-phenoxy)propylcarbamoylamino]benzenesulfonyl fluoride Openeye Name: 3-[3-(2-chloro-4-nitro-phenoxy)propylcarbamoylamino]benzenesulfonyl fluoride CAS Name: 3-[[[3-(2-chloro-4-nitrophenoxy)propylamino]-oxomethyl]amino]benzenesulfonyl fluoride IUPAC Name: 3-[3-(2-chloro-4-nitrophenoxy)propylcarbamoylamino]benzenesulfonyl fluoride Traditional Name: 3-[3-(2-chloro-4-nitro-phenoxy)propylcarbamoylamino]benzenesulfonyl fluoride Formula: C16H15ClFN3O6S MolecularWeight: 431.823203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)F)NC(=O)NCCCOC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)F)NC(=O)NCCCOC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15ClFN3O6S/c17-14-10-12(21(23)24)5-6-15(14)27-8-2-7-19-16(22)20-11-3-1-4-13(9-11)28(18,25)26/h1,3-6,9-10H,2,7-8H2,(H2,19,20,22)