2-fluoranyl-5-[[(2Z)-2-(nitromethylidene)imidazolidin-1-yl]methyl]pyridine; 4-methylbenzenesulfonic acid

Systemtic Name: 2-fluoranyl-5-[[(2Z)-2-(nitromethylidene)imidazolidin-1-yl]methyl]pyridine; 4-methylbenzenesulfonic acid Openeye Name: 2-fluoro-5-[[(2Z)-2-(nitromethylene)imidazolidin-1-yl]methyl]pyridine; 4-methylbenzenesulfonic acid CAS Name: 2-fluoro-5-[[(2Z)-2-(nitromethylidene)-1-imidazolidinyl]methyl]pyridine; 4-methylbenzenesulfonic acid IUPAC Name: 2-fluoro-5-[[(2Z)-2-(nitromethylidene)imidazolidin-1-yl]methyl]pyridine; 4-methylbenzenesulfonic acid Traditional Name: 2-fluoro-5-[[(2Z)-2-(nitromethylene)imidazolidin-1-yl]methyl]pyridine; tosylic acid Formula: C17H19FN4O5S MolecularWeight: 410.419963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CN(C(=C[N+](=O)[O-])N1)CC2=CN=C(C=C2)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CN(/C(=C\[N+](=O)[O-])/N1)CC2=CN=C(C=C2)F

InChI

InChI=1S/C10H11FN4O2.C7H8O3S/c11-9-2-1-8(5-13-9)6-14-4-3-12-10(14)7-15(16)17;1-6-2-4-7(5-3-6)11(8,9)10/h1-2,5,7,12H,3-4,6H2;2-5H,1H3,(H,8,9,10)/b10-7-;