(4-aminocarbonyl-2-nitro-phenyl)methyl-cyclohexyl-[(4-fluorophenyl)methyl]azanium

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl-cyclohexyl-[(4-fluorophenyl)methyl]azanium Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl-cyclohexyl-[(4-fluorophenyl)methyl]ammonium CAS Name: (4-carbamoyl-2-nitrophenyl)methyl-cyclohexyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl-cyclohexyl-[(4-fluorophenyl)methyl]azanium Traditional Name: (4-carbamoyl-2-nitro-benzyl)-cyclohexyl-(4-fluorobenzyl)ammonium Formula: C21H25FN3O3+ MolecularWeight: 386.439903

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+](CC2=CC=C(C=C2)F)CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)[NH+](CC2=CC=C(C=C2)F)CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C21H24FN3O3/c22-18-10-6-15(7-11-18)13-24(19-4-2-1-3-5-19)14-17-9-8-16(21(23)26)12-20(17)25(27)28/h6-12,19H,1-5,13-14H2,(H2,23,26)/p+1