2-(4-chloranyl-2-methyl-phenoxy)-N-octadecyl-ethanamide

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-N-octadecyl-ethanamide Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-N-octadecyl-acetamide CAS Name: 2-(4-chloro-2-methylphenoxy)-N-octadecylacetamide IUPAC Name: 2-(4-chloro-2-methylphenoxy)-N-octadecylacetamide Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-N-stearyl-acetamide Formula: C27H46ClNO2 MolecularWeight: 452.11264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)COC1=C(C=C(C=C1)Cl)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)COC1=C(C=C(C=C1)Cl)C

InChI

InChI=1S/C27H46ClNO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29-27(30)23-31-26-20-19-25(28)22-24(26)2/h19-20,22H,3-18,21,23H2,1-2H3,(H,29,30)