N-tert-butyl-4-[(4-fluorophenyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[(4-fluorophenyl)amino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-(4-fluoroanilino)-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-(4-fluoroanilino)-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-(4-fluoroanilino)-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-(4-fluoroanilino)-3-nitro-benzenesulfonamide Formula: C16H18FN3O4S MolecularWeight: 367.395223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H18FN3O4S/c1-16(2,3)19-25(23,24)13-8-9-14(15(10-13)20(21)22)18-12-6-4-11(17)5-7-12/h4-10,18-19H,1-3H3