3-[4-chloranyl-2-(trifluoromethyl)phenyl]-1-heptyl-1-[[4-(2-methyl-2-oxidanyl-propoxy)phenyl]methyl]urea

Systemtic Name: 3-[4-chloranyl-2-(trifluoromethyl)phenyl]-1-heptyl-1-[[4-(2-methyl-2-oxidanyl-propoxy)phenyl]methyl]urea Openeye Name: 3-[4-chloro-2-(trifluoromethyl)phenyl]-1-heptyl-1-[[4-(2-hydroxy-2-methyl-propoxy)phenyl]methyl]urea CAS Name: 3-[4-chloro-2-(trifluoromethyl)phenyl]-1-heptyl-1-[[4-(2-hydroxy-2-methylpropoxy)phenyl]methyl]urea IUPAC Name: 3-[4-chloro-2-(trifluoromethyl)phenyl]-1-heptyl-1-[[4-(2-hydroxy-2-methylpropoxy)phenyl]methyl]urea Traditional Name: 3-[4-chloro-2-(trifluoromethyl)phenyl]-1-heptyl-1-[4-(2-hydroxy-2-methyl-propoxy)benzyl]urea Formula: C26H34ClF3N2O3 MolecularWeight: 515.00797

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)OCC(C)(C)O)C(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)OCC(C)(C)O)C(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C26H34ClF3N2O3/c1-4-5-6-7-8-15-32(17-19-9-12-21(13-10-19)35-18-25(2,3)34)24(33)31-23-14-11-20(27)16-22(23)26(28,29)30/h9-14,16,34H,4-8,15,17-18H2,1-3H3,(H,31,33)