3-fluoranyl-2-nitro-N-phenethyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-fluoranyl-2-nitro-N-phenethyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-fluoro-2-nitro-N-phenethyl-benzenesulfonamide CAS Name: 3-fluoro-2-nitro-N-phenethyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-fluoro-2-nitro-N-phenethylbenzenesulfonamide Traditional Name: N-benzyl-3-fluoro-2-nitro-N-phenethyl-benzenesulfonamide Formula: C21H19FN2O4S MolecularWeight: 414.449963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3[N+](=O)[O-])F

InChI

InChI=1S/C21H19FN2O4S/c22-19-12-7-13-20(21(19)24(25)26)29(27,28)23(16-18-10-5-2-6-11-18)15-14-17-8-3-1-4-9-17/h1-13H,14-16H2