[4-(4-bromophenyl)sulfonyl-3-nitro-phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-(4-bromophenyl)sulfonyl-3-nitro-phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-(4-bromophenyl)sulfonyl-3-nitro-phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-(4-bromophenyl)sulfonyl-3-nitrophenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-(4-bromophenyl)sulfonyl-3-nitrophenyl]-pyrrolidin-1-ylmethanone Traditional Name: (4-brosyl-3-nitro-phenyl)-pyrrolidino-methanone Formula: C17H15BrN2O5S MolecularWeight: 439.2804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN2O5S/c18-13-4-6-14(7-5-13)26(24,25)16-8-3-12(11-15(16)20(22)23)17(21)19-9-1-2-10-19/h3-8,11H,1-2,9-10H2