1-[2-[(2S)-2-(6-fluoranyl-1H-benzimidazol-2-yl)pyrrolidin-1-yl]ethyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[2-[(2S)-2-(6-fluoranyl-1H-benzimidazol-2-yl)pyrrolidin-1-yl]ethyl]piperidin-1-ium-4-ol Openeye Name: 1-[2-[(2S)-2-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]ethyl]piperidin-1-ium-4-ol CAS Name: 1-[2-[(2S)-2-(6-fluoro-1H-benzimidazol-2-yl)-1-pyrrolidinyl]ethyl]-4-piperidin-1-iumol IUPAC Name: 1-[2-[(2S)-2-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]ethyl]piperidin-1-ium-4-ol Traditional Name: 1-[2-[(2S)-2-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidino]ethyl]piperidin-1-ium-4-ol Formula: C18H26FN4O+ MolecularWeight: 333.423643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC[NH+]2CCC(CC2)O)C3=NC4=C(N3)C=C(C=C4)F

Isomeric SMILES

C1C[C@H](N(C1)CC[NH+]2CCC(CC2)O)C3=NC4=C(N3)C=C(C=C4)F

InChI

InChI=1S/C18H25FN4O/c19-13-3-4-15-16(12-13)21-18(20-15)17-2-1-7-23(17)11-10-22-8-5-14(24)6-9-22/h3-4,12,14,17,24H,1-2,5-11H2,(H,20,21)/p+1/t17-/m0/s1