1-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-3-octadecyl-urea

Systemtic Name: 1-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-3-octadecyl-urea Openeye Name: 1-[2-(3,4-dihydroxyphenyl)ethyl]-3-octadecyl-urea CAS Name: 1-[2-(3,4-dihydroxyphenyl)ethyl]-3-octadecylurea IUPAC Name: 1-[2-(3,4-dihydroxyphenyl)ethyl]-3-octadecylurea Traditional Name: 1-[2-(3,4-dihydroxyphenyl)ethyl]-3-stearyl-urea Formula: C27H48N2O3 MolecularWeight: 448.68162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NCCC1=CC(=C(C=C1)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NCCC1=CC(=C(C=C1)O)O

InChI

InChI=1S/C27H48N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-28-27(32)29-22-20-24-18-19-25(30)26(31)23-24/h18-19,23,30-31H,2-17,20-22H2,1H3,(H2,28,29,32)