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

Systemtic Name: 4-fluoranyl-3-nitro-N-phenethyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-fluoro-3-nitro-N-phenethyl-benzenesulfonamide CAS Name: 4-fluoro-3-nitro-N-phenethyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-fluoro-3-nitro-N-phenethylbenzenesulfonamide Traditional Name: N-benzyl-4-fluoro-3-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(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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