1-[5-methyl-2-(trifluoromethyl)furan-3-yl]-3-(3-morpholin-4-ium-4-ylpropyl)urea

Systemtic Name: 1-[5-methyl-2-(trifluoromethyl)furan-3-yl]-3-(3-morpholin-4-ium-4-ylpropyl)urea Openeye Name: 1-[5-methyl-2-(trifluoromethyl)-3-furyl]-3-(3-morpholin-4-ium-4-ylpropyl)urea CAS Name: 1-[5-methyl-2-(trifluoromethyl)-3-furanyl]-3-[3-(4-morpholin-4-iumyl)propyl]urea IUPAC Name: 1-[5-methyl-2-(trifluoromethyl)furan-3-yl]-3-(3-morpholin-4-ium-4-ylpropyl)urea Traditional Name: 1-[5-methyl-2-(trifluoromethyl)-3-furyl]-3-(3-morpholin-4-ium-4-ylpropyl)urea Formula: C14H21F3N3O3+ MolecularWeight: 336.33005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C(F)(F)F)NC(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

CC1=CC(=C(O1)C(F)(F)F)NC(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C14H20F3N3O3/c1-10-9-11(12(23-10)14(15,16)17)19-13(21)18-3-2-4-20-5-7-22-8-6-20/h9H,2-8H2,1H3,(H2,18,19,21)/p+1