4-[butyl-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]butanoic acid Openeye Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enoyl]amino]butanoic acid CAS Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoyl]amino]butanoic acid Traditional Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acryloyl]amino]butyric acid Formula: C25H39NO4 MolecularWeight: 417.58146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC(=O)O)C(=O)C=CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCN(CCCC(=O)O)C(=O)/C=C/C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C25H39NO4/c1-8-9-14-26(15-10-11-22(28)29)21(27)13-12-18-16-19(24(2,3)4)23(30)20(17-18)25(5,6)7/h12-13,16-17,30H,8-11,14-15H2,1-7H3,(H,28,29)/b13-12+