1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[2-(1-piperidin-1-iumyl)ethyl]urea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2-piperidin-1-ium-1-ylethyl)urea Formula: C14H20ClFN3O+ MolecularWeight: 300.779503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C14H19ClFN3O/c15-12-10-11(4-5-13(12)16)18-14(20)17-6-9-19-7-2-1-3-8-19/h4-5,10H,1-3,6-9H2,(H2,17,18,20)/p+1