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

Systemtic Name: N-(2-fluoranyl-5-nitro-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-fluoro-5-nitro-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(2-fluoro-5-nitrophenyl)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-fluoro-5-nitrophenyl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2-fluoro-5-nitro-phenyl)-4-pyrrolidinosulfonyl-benzamide Formula: C17H16FN3O5S MolecularWeight: 393.389443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FN3O5S/c18-15-8-5-13(21(23)24)11-16(15)19-17(22)12-3-6-14(7-4-12)27(25,26)20-9-1-2-10-20/h3-8,11H,1-2,9-10H2,(H,19,22)