N-[(3-fluorophenyl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(3-fluorophenyl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(3-fluorophenyl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-[(3-fluorophenyl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(3-fluorophenyl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-(3-fluorobenzyl)-4-nitro-benzenesulfonamide Formula: C13H11FN2O4S MolecularWeight: 310.300843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)F)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11FN2O4S/c14-11-3-1-2-10(8-11)9-15-21(19,20)13-6-4-12(5-7-13)16(17)18/h1-8,15H,9H2