2-bromanyl-N-(4-fluoranyl-3-nitro-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-(4-fluoranyl-3-nitro-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(4-fluoro-3-nitro-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-(4-fluoro-3-nitrophenyl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(4-fluoro-3-nitrophenyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(4-fluoro-3-nitro-phenyl)-5-pyrrolidinosulfonyl-benzamide Formula: C17H15BrFN3O5S MolecularWeight: 472.285503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrFN3O5S/c18-14-5-4-12(28(26,27)21-7-1-2-8-21)10-13(14)17(23)20-11-3-6-15(19)16(9-11)22(24)25/h3-6,9-10H,1-2,7-8H2,(H,20,23)