diethyl-[2-[[1-(2-fluorophenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylideneamino]ethyl]azanium

Systemtic Name: diethyl-[2-[[1-(2-fluorophenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylideneamino]ethyl]azanium Openeye Name: diethyl-[2-[[1-(2-fluorophenyl)-2,4,6-trioxo-hexahydropyrimidin-5-yl]methyleneamino]ethyl]ammonium CAS Name: diethyl-[2-[[1-(2-fluorophenyl)-2,4,6-trioxo-1,3-diazinan-5-yl]methylideneamino]ethyl]ammonium IUPAC Name: diethyl-[2-[[1-(2-fluorophenyl)-2,4,6-trioxo-1,3-diazinan-5-yl]methylideneamino]ethyl]azanium Traditional Name: diethyl-[2-[[1-(2-fluorophenyl)-2,4,6-triketo-hexahydropyrimidin-5-yl]methyleneamino]ethyl]ammonium Formula: C17H22FN4O3+ MolecularWeight: 349.379983

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN=CC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2F

Isomeric SMILES

CC[NH+](CC)CCN=CC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2F

InChI

InChI=1S/C17H21FN4O3/c1-3-21(4-2)10-9-19-11-12-15(23)20-17(25)22(16(12)24)14-8-6-5-7-13(14)18/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,20,23,25)/p+1