[2,6-ditert-butyl-3-[(2-chloranylethanoylamino)methyl]-4-oxidanyl-phenyl] ethanoate

Systemtic Name: [2,6-ditert-butyl-3-[(2-chloranylethanoylamino)methyl]-4-oxidanyl-phenyl] ethanoate Openeye Name: [2,6-ditert-butyl-3-[[(2-chloroacetyl)amino]methyl]-4-hydroxy-phenyl] acetate CAS Name: acetic acid [2,6-ditert-butyl-3-[[(2-chloro-1-oxoethyl)amino]methyl]-4-hydroxyphenyl] ester IUPAC Name: [2,6-ditert-butyl-3-[[(2-chloroacetyl)amino]methyl]-4-hydroxyphenyl] acetate Traditional Name: acetic acid [2,6-ditert-butyl-3-[[(2-chloroacetyl)amino]methyl]-4-hydroxy-phenyl] ester Formula: C19H28ClNO4 MolecularWeight: 369.88292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C=C1C(C)(C)C)O)CNC(=O)CCl)C(C)(C)C

Isomeric SMILES

CC(=O)OC1=C(C(=C(C=C1C(C)(C)C)O)CNC(=O)CCl)C(C)(C)C

InChI

InChI=1S/C19H28ClNO4/c1-11(22)25-17-13(18(2,3)4)8-14(23)12(10-21-15(24)9-20)16(17)19(5,6)7/h8,23H,9-10H2,1-7H3,(H,21,24)