benzene; 3-[2,4-bis(fluoranyl)phenyl]-1-heptyl-1-(1-phenylethyl)urea

Systemtic Name: benzene; 3-[2,4-bis(fluoranyl)phenyl]-1-heptyl-1-(1-phenylethyl)urea Openeye Name: benzene; 3-(2,4-difluorophenyl)-1-heptyl-1-(1-phenylethyl)urea CAS Name: benzene; 3-(2,4-difluorophenyl)-1-heptyl-1-(1-phenylethyl)urea IUPAC Name: benzene; 3-(2,4-difluorophenyl)-1-heptyl-1-(1-phenylethyl)urea Traditional Name: benzene; 3-(2,4-difluorophenyl)-1-heptyl-1-(1-phenylethyl)urea Formula: C28H34F2N2O MolecularWeight: 452.579166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28F2N2O.C6H6/c1-3-4-5-6-10-15-26(17(2)18-11-8-7-9-12-18)22(27)25-21-14-13-19(23)16-20(21)24;1-2-4-6-5-3-1/h7-9,11-14,16-17H,3-6,10,15H2,1-2H3,(H,25,27);1-6H