1-heptyl-1-phenethyl-3-[3-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-heptyl-1-phenethyl-3-[3-(trifluoromethyl)phenyl]urea Openeye Name: 1-heptyl-1-phenethyl-3-[3-(trifluoromethyl)phenyl]urea CAS Name: 1-heptyl-1-phenethyl-3-[3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-heptyl-1-phenethyl-3-[3-(trifluoromethyl)phenyl]urea Traditional Name: 1-heptyl-1-phenethyl-3-[3-(trifluoromethyl)phenyl]urea Formula: C23H29F3N2O MolecularWeight: 406.48437

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCC1=CC=CC=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCCCCCN(CCC1=CC=CC=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C23H29F3N2O/c1-2-3-4-5-9-16-28(17-15-19-11-7-6-8-12-19)22(29)27-21-14-10-13-20(18-21)23(24,25)26/h6-8,10-14,18H,2-5,9,15-17H2,1H3,(H,27,29)