1-(1-ethylpiperidin-1-ium-4-yl)-3-[(3-fluoranyl-4-methyl-phenyl)methyl]urea

Systemtic Name: 1-(1-ethylpiperidin-1-ium-4-yl)-3-[(3-fluoranyl-4-methyl-phenyl)methyl]urea Openeye Name: 1-(1-ethylpiperidin-1-ium-4-yl)-3-[(3-fluoro-4-methyl-phenyl)methyl]urea CAS Name: 1-(1-ethyl-4-piperidin-1-iumyl)-3-[(3-fluoro-4-methylphenyl)methyl]urea IUPAC Name: 1-(1-ethylpiperidin-1-ium-4-yl)-3-[(3-fluoro-4-methylphenyl)methyl]urea Traditional Name: 1-(1-ethylpiperidin-1-ium-4-yl)-3-(3-fluoro-4-methyl-benzyl)urea Formula: C16H25FN3O+ MolecularWeight: 294.387603

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)NCC2=CC(=C(C=C2)C)F

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)NCC2=CC(=C(C=C2)C)F

InChI

InChI=1S/C16H24FN3O/c1-3-20-8-6-14(7-9-20)19-16(21)18-11-13-5-4-12(2)15(17)10-13/h4-5,10,14H,3,6-9,11H2,1-2H3,(H2,18,19,21)/p+1