1-(4-fluorophenyl)-3-[2-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]ethyl]urea

Systemtic Name: 1-(4-fluorophenyl)-3-[2-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]ethyl]urea Openeye Name: 1-(4-fluorophenyl)-3-[2-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]ethyl]urea CAS Name: 1-(4-fluorophenyl)-3-[2-[(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]ethyl]urea IUPAC Name: 1-(4-fluorophenyl)-3-[2-[(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]ethyl]urea Traditional Name: 1-(4-fluorophenyl)-3-[2-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]ethyl]urea Formula: C20H26FN4O+ MolecularWeight: 357.445043

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)CCNC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C[NH+]1CCN([C@H](C1)C2=CC=CC=C2)CCNC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H25FN4O/c1-24-13-14-25(19(15-24)16-5-3-2-4-6-16)12-11-22-20(26)23-18-9-7-17(21)8-10-18/h2-10,19H,11-15H2,1H3,(H2,22,23,26)/p+1/t19-/m1/s1