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

Systemtic Name: 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]ethanoic acid Openeye Name: 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enoyl]amino]acetic acid CAS Name: 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxoprop-2-enyl]amino]acetic acid IUPAC Name: 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoyl]amino]acetic acid Traditional Name: 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acryloyl]amino]acetic acid Formula: C23H35NO4 MolecularWeight: 389.5283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H35NO4/c1-8-9-12-24(15-20(26)27)19(25)11-10-16-13-17(22(2,3)4)21(28)18(14-16)23(5,6)7/h10-11,13-14,28H,8-9,12,15H2,1-7H3,(H,26,27)/b11-10+