[4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-3-fluoranyl-phenyl] thiocyanate

Systemtic Name: [4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-3-fluoranyl-phenyl] thiocyanate Openeye Name: [4-[(4-chloro-3-nitro-phenyl)sulfonylamino]-3-fluoro-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(4-chloro-3-nitrophenyl)sulfonylamino]-3-fluorophenyl] ester IUPAC Name: [4-[(4-chloro-3-nitrophenyl)sulfonylamino]-3-fluorophenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(4-chloro-3-nitro-phenyl)sulfonylamino]-3-fluoro-phenyl] ester Formula: C13H7ClFN3O4S2 MolecularWeight: 387.793783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SC#N)F)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1SC#N)F)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H7ClFN3O4S2/c14-10-3-2-9(6-13(10)18(19)20)24(21,22)17-12-4-1-8(23-7-16)5-11(12)15/h1-6,17H