3-[(3R)-1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide

Systemtic Name: 3-[(3R)-1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide Openeye Name: 3-[(3R)-1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide CAS Name: 3-[(3R)-1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-3-piperidin-1-iumyl]-N-(2-fluorophenyl)propanamide IUPAC Name: 3-[(3R)-1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propanamide Traditional Name: 3-[(3R)-1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]-N-(2-fluorophenyl)propionamide Formula: C21H30FN4O+ MolecularWeight: 373.487503

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C)C[NH+]2CCCC(C2)CCC(=O)NC3=CC=CC=C3F

Isomeric SMILES

CCC1=NC(=C(N1)C)C[NH+]2CCC[C@@H](C2)CCC(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C21H29FN4O/c1-3-20-23-15(2)19(24-20)14-26-12-6-7-16(13-26)10-11-21(27)25-18-9-5-4-8-17(18)22/h4-5,8-9,16H,3,6-7,10-14H2,1-2H3,(H,23,24)(H,25,27)/p+1/t16-/m1/s1