3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propyl 2-(cyclohexylamino)-2-oxidanylidene-ethanoate

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propyl 2-(cyclohexylamino)-2-oxidanylidene-ethanoate Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propyl 2-(cyclohexylamino)-2-oxo-acetate CAS Name: 2-(cyclohexylamino)-2-oxoacetic acid 3-(3,5-ditert-butyl-4-hydroxyphenyl)propyl ester IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propyl 2-(cyclohexylamino)-2-oxoacetate Traditional Name: 2-(cyclohexylamino)-2-keto-acetic acid 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propyl ester Formula: C25H39NO4 MolecularWeight: 417.58146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCOC(=O)C(=O)NC2CCCCC2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCOC(=O)C(=O)NC2CCCCC2

InChI

InChI=1S/C25H39NO4/c1-24(2,3)19-15-17(16-20(21(19)27)25(4,5)6)11-10-14-30-23(29)22(28)26-18-12-8-7-9-13-18/h15-16,18,27H,7-14H2,1-6H3,(H,26,28)