1-heptyl-1-phenethyl-3-[2,4,5-tris(chloranyl)phenyl]urea

Systemtic Name: 1-heptyl-1-phenethyl-3-[2,4,5-tris(chloranyl)phenyl]urea Openeye Name: 1-heptyl-1-phenethyl-3-(2,4,5-trichlorophenyl)urea CAS Name: 1-heptyl-1-phenethyl-3-(2,4,5-trichlorophenyl)urea IUPAC Name: 1-heptyl-1-phenethyl-3-(2,4,5-trichlorophenyl)urea Traditional Name: 1-heptyl-1-phenethyl-3-(2,4,5-trichlorophenyl)urea Formula: C22H27Cl3N2O MolecularWeight: 441.82158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCC1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCCCCCCN(CCC1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C22H27Cl3N2O/c1-2-3-4-5-9-13-27(14-12-17-10-7-6-8-11-17)22(28)26-21-16-19(24)18(23)15-20(21)25/h6-8,10-11,15-16H,2-5,9,12-14H2,1H3,(H,26,28)