1-butyl-3-[(4-chloranyl-2-fluoranyl-phenyl)methyl]urea

Systemtic Name: 1-butyl-3-[(4-chloranyl-2-fluoranyl-phenyl)methyl]urea Openeye Name: 1-butyl-3-[(4-chloro-2-fluoro-phenyl)methyl]urea CAS Name: 1-butyl-3-[(4-chloro-2-fluorophenyl)methyl]urea IUPAC Name: 1-butyl-3-[(4-chloro-2-fluorophenyl)methyl]urea Traditional Name: 1-butyl-3-(4-chloro-2-fluoro-benzyl)urea Formula: C12H16ClFN2O MolecularWeight: 258.719643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NCC1=C(C=C(C=C1)Cl)F

Isomeric SMILES

CCCCNC(=O)NCC1=C(C=C(C=C1)Cl)F

InChI

InChI=1S/C12H16ClFN2O/c1-2-3-6-15-12(17)16-8-9-4-5-10(13)7-11(9)14/h4-5,7H,2-3,6,8H2,1H3,(H2,15,16,17)