3-[2,4-bis(fluoranyl)phenyl]-1-(3,3-dimethyl-5-oxidanyl-pentyl)-1-heptyl-urea

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-(3,3-dimethyl-5-oxidanyl-pentyl)-1-heptyl-urea Openeye Name: 3-(2,4-difluorophenyl)-1-heptyl-1-(5-hydroxy-3,3-dimethyl-pentyl)urea CAS Name: 3-(2,4-difluorophenyl)-1-heptyl-1-(5-hydroxy-3,3-dimethylpentyl)urea IUPAC Name: 3-(2,4-difluorophenyl)-1-heptyl-1-(5-hydroxy-3,3-dimethylpentyl)urea Traditional Name: 3-(2,4-difluorophenyl)-1-heptyl-1-(5-hydroxy-3,3-dimethyl-pentyl)urea Formula: C21H34F2N2O2 MolecularWeight: 384.503666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCC(C)(C)CCO)C(=O)NC1=C(C=C(C=C1)F)F

Isomeric SMILES

CCCCCCCN(CCC(C)(C)CCO)C(=O)NC1=C(C=C(C=C1)F)F

InChI

InChI=1S/C21H34F2N2O2/c1-4-5-6-7-8-13-25(14-11-21(2,3)12-15-26)20(27)24-19-10-9-17(22)16-18(19)23/h9-10,16,26H,4-8,11-15H2,1-3H3,(H,24,27)