1-(3-chloranyl-5-methyl-4-oxidanyl-phenyl)-3-octadecyl-urea

Systemtic Name: 1-(3-chloranyl-5-methyl-4-oxidanyl-phenyl)-3-octadecyl-urea Openeye Name: 1-(3-chloro-4-hydroxy-5-methyl-phenyl)-3-octadecyl-urea CAS Name: 1-(3-chloro-4-hydroxy-5-methylphenyl)-3-octadecylurea IUPAC Name: 1-(3-chloro-4-hydroxy-5-methylphenyl)-3-octadecylurea Traditional Name: 1-(3-chloro-4-hydroxy-5-methyl-phenyl)-3-stearyl-urea Formula: C26H45ClN2O2 MolecularWeight: 453.1007

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NC1=CC(=C(C(=C1)C)O)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NC1=CC(=C(C(=C1)C)O)Cl

InChI

InChI=1S/C26H45ClN2O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-28-26(31)29-23-20-22(2)25(30)24(27)21-23/h20-21,30H,3-19H2,1-2H3,(H2,28,29,31)