ethyl (E)-3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylamino]but-2-enoate

Systemtic Name: ethyl (E)-3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylamino]but-2-enoate Openeye Name: ethyl (E)-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylamino]but-2-enoate CAS Name: (E)-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylamino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylamino]but-2-enoate Traditional Name: (E)-3-[(3,5-ditert-butyl-4-hydroxy-benzyl)amino]but-2-enoic acid ethyl ester Formula: C21H33NO3 MolecularWeight: 347.49162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCOC(=O)/C=C(\C)/NCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C21H33NO3/c1-9-25-18(23)10-14(2)22-13-15-11-16(20(3,4)5)19(24)17(12-15)21(6,7)8/h10-12,22,24H,9,13H2,1-8H3/b14-10+