2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoylamino]ethyl octadecanoate

Systemtic Name: 2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoylamino]ethyl octadecanoate Openeye Name: 2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoylamino]ethyl octadecanoate CAS Name: octadecanoic acid 2-[[3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxopropyl]amino]ethyl ester IUPAC Name: 2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoylamino]ethyl octadecanoate Traditional Name: stearic acid 2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoylamino]ethyl ester Formula: C37H65NO4 MolecularWeight: 587.9163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCNC(=O)CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCNC(=O)CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C37H65NO4/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-34(40)42-27-26-38-33(39)25-24-30-28-31(36(2,3)4)35(41)32(29-30)37(5,6)7/h28-29,41H,8-27H2,1-7H3,(H,38,39)