1-octadecyl-3-(2,4,6-trimethylphenyl)urea

Systemtic Name: 1-octadecyl-3-(2,4,6-trimethylphenyl)urea Openeye Name: 1-octadecyl-3-(2,4,6-trimethylphenyl)urea CAS Name: 1-octadecyl-3-(2,4,6-trimethylphenyl)urea IUPAC Name: 1-octadecyl-3-(2,4,6-trimethylphenyl)urea Traditional Name: 1-mesityl-3-stearyl-urea Formula: C28H50N2O MolecularWeight: 430.7094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NC1=C(C=C(C=C1C)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NC1=C(C=C(C=C1C)C)C

InChI

InChI=1S/C28H50N2O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-29-28(31)30-27-25(3)22-24(2)23-26(27)4/h22-23H,5-21H2,1-4H3,(H2,29,30,31)