3-[2,4-bis(fluoranyl)phenyl]-1-[(4-butoxyphenyl)methyl]-1-heptyl-urea

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-[(4-butoxyphenyl)methyl]-1-heptyl-urea Openeye Name: 1-[(4-butoxyphenyl)methyl]-3-(2,4-difluorophenyl)-1-heptyl-urea CAS Name: 1-[(4-butoxyphenyl)methyl]-3-(2,4-difluorophenyl)-1-heptylurea IUPAC Name: 1-[(4-butoxyphenyl)methyl]-3-(2,4-difluorophenyl)-1-heptylurea Traditional Name: 1-(4-butoxybenzyl)-3-(2,4-difluorophenyl)-1-heptyl-urea Formula: C25H34F2N2O2 MolecularWeight: 432.546466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34F2N2O2/c1-3-5-7-8-9-16-29(25(30)28-24-15-12-21(26)18-23(24)27)19-20-10-13-22(14-11-20)31-17-6-4-2/h10-15,18H,3-9,16-17,19H2,1-2H3,(H,28,30)