N-(4-bromophenyl)-3-nitro-4-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: N-(4-bromophenyl)-3-nitro-4-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: N-(4-bromophenyl)-3-nitro-4-pyrrolidin-1-yl-benzenesulfonamide CAS Name: N-(4-bromophenyl)-3-nitro-4-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-(4-bromophenyl)-3-nitro-4-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: N-(4-bromophenyl)-3-nitro-4-pyrrolidino-benzenesulfonamide Formula: C16H16BrN3O4S MolecularWeight: 426.28494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H16BrN3O4S/c17-12-3-5-13(6-4-12)18-25(23,24)14-7-8-15(16(11-14)20(21)22)19-9-1-2-10-19/h3-8,11,18H,1-2,9-10H2