1-[2,5-bis(oxidanyl)phenyl]-3-hexadecyl-urea

Systemtic Name: 1-[2,5-bis(oxidanyl)phenyl]-3-hexadecyl-urea Openeye Name: 1-(2,5-dihydroxyphenyl)-3-hexadecyl-urea CAS Name: 1-(2,5-dihydroxyphenyl)-3-hexadecylurea IUPAC Name: 1-(2,5-dihydroxyphenyl)-3-hexadecylurea Traditional Name: 1-cetyl-3-(2,5-dihydroxyphenyl)urea Formula: C23H40N2O3 MolecularWeight: 392.5753

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)NC1=C(C=CC(=C1)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)NC1=C(C=CC(=C1)O)O

InChI

InChI=1S/C23H40N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24-23(28)25-21-19-20(26)16-17-22(21)27/h16-17,19,26-27H,2-15,18H2,1H3,(H2,24,25,28)