5-(3-tert-butyl-4-oxidanyl-phenoxy)-12-chloranyl-dodecanamide

Systemtic Name: 5-(3-tert-butyl-4-oxidanyl-phenoxy)-12-chloranyl-dodecanamide Openeye Name: 5-(3-tert-butyl-4-hydroxy-phenoxy)-12-chloro-dodecanamide CAS Name: 5-(3-tert-butyl-4-hydroxyphenoxy)-12-chlorododecanamide IUPAC Name: 5-(3-tert-butyl-4-hydroxyphenoxy)-12-chlorododecanamide Traditional Name: 5-(3-tert-butyl-4-hydroxy-phenoxy)-12-chloro-lauramide Formula: C22H36ClNO3 MolecularWeight: 397.97914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)OC(CCCCCCCCl)CCCC(=O)N)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)OC(CCCCCCCCl)CCCC(=O)N)O

InChI

InChI=1S/C22H36ClNO3/c1-22(2,3)19-16-18(13-14-20(19)25)27-17(11-9-12-21(24)26)10-7-5-4-6-8-15-23/h13-14,16-17,25H,4-12,15H2,1-3H3,(H2,24,26)