N-[2,2-bis(4-fluorophenyl)ethyl]-4-(4-nitrophenyl)cyclohexan-1-amine sulfate

Systemtic Name: N-[2,2-bis(4-fluorophenyl)ethyl]-4-(4-nitrophenyl)cyclohexan-1-amine sulfate Openeye Name: N-[2,2-bis(4-fluorophenyl)ethyl]-4-(4-nitrophenyl)cyclohexanamine sulfate CAS Name: N-[2,2-bis(4-fluorophenyl)ethyl]-4-(4-nitrophenyl)-1-cyclohexanamine sulfate IUPAC Name: N-[2,2-bis(4-fluorophenyl)ethyl]-4-(4-nitrophenyl)cyclohexan-1-amine sulfate Traditional Name: 2,2-bis(4-fluorophenyl)ethyl-[4-(4-nitrophenyl)cyclohexyl]amine sulfate Formula: C26H26F2N2O6S-2 MolecularWeight: 532.556246

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=C(C=C2)[N+](=O)[O-])NCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1CC(CCC1C2=CC=C(C=C2)[N+](=O)[O-])NCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C26H26F2N2O2.H2O4S/c27-22-9-1-20(2-10-22)26(21-3-11-23(28)12-4-21)17-29-24-13-5-18(6-14-24)19-7-15-25(16-8-19)30(31)32;1-5(2,3)4/h1-4,7-12,15-16,18,24,26,29H,5-6,13-14,17H2;(H2,1,2,3,4)/p-2