1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(4-fluoranyl-2-nitro-phenyl)piperazine

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(4-fluoranyl-2-nitro-phenyl)piperazine Openeye Name: 1-(4-fluoro-2-nitro-phenyl)-4-indan-5-ylsulfonyl-piperazine CAS Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(4-fluoro-2-nitrophenyl)piperazine IUPAC Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(4-fluoro-2-nitrophenyl)piperazine Traditional Name: 1-(4-fluoro-2-nitro-phenyl)-4-indan-5-ylsulfonyl-piperazine Formula: C19H20FN3O4S MolecularWeight: 405.443203

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C19H20FN3O4S/c20-16-5-7-18(19(13-16)23(24)25)21-8-10-22(11-9-21)28(26,27)17-6-4-14-2-1-3-15(14)12-17/h4-7,12-13H,1-3,8-11H2