1-(4-fluoranyl-2-nitro-phenyl)-4-(phenylsulfonyl)piperazine

Systemtic Name: 1-(4-fluoranyl-2-nitro-phenyl)-4-(phenylsulfonyl)piperazine Openeye Name: 1-(benzenesulfonyl)-4-(4-fluoro-2-nitro-phenyl)piperazine CAS Name: 1-(benzenesulfonyl)-4-(4-fluoro-2-nitrophenyl)piperazine IUPAC Name: 1-(benzenesulfonyl)-4-(4-fluoro-2-nitrophenyl)piperazine Traditional Name: 1-besyl-4-(4-fluoro-2-nitro-phenyl)piperazine Formula: C16H16FN3O4S MolecularWeight: 365.379343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)F)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)F)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H16FN3O4S/c17-13-6-7-15(16(12-13)20(21)22)18-8-10-19(11-9-18)25(23,24)14-4-2-1-3-5-14/h1-7,12H,8-11H2