(3-fluorophenyl)-[(2S)-2-(piperazin-4-ium-1-ylmethyl)pyrrolidin-1-yl]methanone

Systemtic Name: (3-fluorophenyl)-[(2S)-2-(piperazin-4-ium-1-ylmethyl)pyrrolidin-1-yl]methanone Openeye Name: (3-fluorophenyl)-[(2S)-2-(piperazin-4-ium-1-ylmethyl)pyrrolidin-1-yl]methanone CAS Name: (3-fluorophenyl)-[(2S)-2-(1-piperazin-4-iumylmethyl)-1-pyrrolidinyl]methanone IUPAC Name: (3-fluorophenyl)-[(2S)-2-(piperazin-4-ium-1-ylmethyl)pyrrolidin-1-yl]methanone Traditional Name: (3-fluorophenyl)-[(2S)-2-(piperazin-4-ium-1-ylmethyl)pyrrolidino]methanone Formula: C16H23FN3O+ MolecularWeight: 292.371723

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC(=CC=C2)F)CN3CC[NH2+]CC3

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC(=CC=C2)F)CN3CC[NH2+]CC3

InChI

InChI=1S/C16H22FN3O/c17-14-4-1-3-13(11-14)16(21)20-8-2-5-15(20)12-19-9-6-18-7-10-19/h1,3-4,11,15,18H,2,5-10,12H2/p+1/t15-/m0/s1