4-chloranyl-N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-fluoranyl-benzamide

Systemtic Name: 4-chloranyl-N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-fluoranyl-benzamide Openeye Name: 4-chloro-N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-fluoro-benzamide CAS Name: 4-chloro-N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-2-fluorobenzamide IUPAC Name: 4-chloro-N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-fluorobenzamide Traditional Name: 4-chloro-N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-fluoro-benzamide Formula: C19H27ClFN2O+ MolecularWeight: 353.881883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH+]2CCCC(C2)NC(=O)C3=C(C=C(C=C3)Cl)F

Isomeric SMILES

C1CCCC(CC1)[NH+]2CCC[C@@H](C2)NC(=O)C3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C19H26ClFN2O/c20-14-9-10-17(18(21)12-14)19(24)22-15-6-5-11-23(13-15)16-7-3-1-2-4-8-16/h9-10,12,15-16H,1-8,11,13H2,(H,22,24)/p+1/t15-/m0/s1