[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-pyrrolidin-1-yl-phenyl)methanone

Systemtic Name: [4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-pyrrolidin-1-yl-phenyl)methanone Openeye Name: [4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-pyrrolidin-1-yl-phenyl)methanone CAS Name: [4-(2-fluorophenyl)sulfonyl-1-piperazinyl]-[3-nitro-4-(1-pyrrolidinyl)phenyl]methanone IUPAC Name: [4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-pyrrolidin-1-ylphenyl)methanone Traditional Name: [4-(2-fluorophenyl)sulfonylpiperazino]-(3-nitro-4-pyrrolidino-phenyl)methanone Formula: C21H23FN4O5S MolecularWeight: 462.494523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F)[N+](=O)[O-]

InChI

InChI=1S/C21H23FN4O5S/c22-17-5-1-2-6-20(17)32(30,31)25-13-11-24(12-14-25)21(27)16-7-8-18(19(15-16)26(28)29)23-9-3-4-10-23/h1-2,5-8,15H,3-4,9-14H2