1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]-4-(9H-fluoren-2-ylsulfonyl)piperazine

Systemtic Name: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]-4-(9H-fluoren-2-ylsulfonyl)piperazine Openeye Name: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]-4-(9H-fluoren-2-ylsulfonyl)piperazine CAS Name: 1-[3-(3,5-dimethyl-1-pyrazolyl)-4-nitrophenyl]-4-(9H-fluoren-2-ylsulfonyl)piperazine IUPAC Name: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-(9H-fluoren-2-ylsulfonyl)piperazine Traditional Name: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]-4-(9H-fluoren-2-ylsulfonyl)piperazine Formula: C28H27N5O4S MolecularWeight: 529.61008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C6=CC=CC=C6C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C6=CC=CC=C6C5)[N+](=O)[O-])C

InChI

InChI=1S/C28H27N5O4S/c1-19-15-20(2)32(29-19)28-18-23(7-10-27(28)33(34)35)30-11-13-31(14-12-30)38(36,37)24-8-9-26-22(17-24)16-21-5-3-4-6-25(21)26/h3-10,15,17-18H,11-14,16H2,1-2H3