1-[[(3R)-1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propyl-urea

Systemtic Name: 1-[[(3R)-1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propyl-urea Openeye Name: 1-[[(3R)-1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propyl-urea CAS Name: 1-[[(3R)-1-[2-(4-fluorophenyl)ethyl]-3-piperidin-1-iumyl]methyl]-1-methyl-3-propylurea IUPAC Name: 1-[[(3R)-1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propylurea Traditional Name: 1-[[(3R)-1-[2-(4-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-1-methyl-3-propyl-urea Formula: C19H31FN3O+ MolecularWeight: 336.467343

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N(C)CC1CCC[NH+](C1)CCC2=CC=C(C=C2)F

Isomeric SMILES

CCCNC(=O)N(C)C[C@H]1CCC[NH+](C1)CCC2=CC=C(C=C2)F

InChI

InChI=1S/C19H30FN3O/c1-3-11-21-19(24)22(2)14-17-5-4-12-23(15-17)13-10-16-6-8-18(20)9-7-16/h6-9,17H,3-5,10-15H2,1-2H3,(H,21,24)/p+1/t17-/m1/s1