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

Systemtic Name: 2-[[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]ethanoic acid Openeye Name: 2-[[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enoyl]amino]acetic acid CAS Name: 2-[[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxoprop-2-enyl]amino]acetic acid IUPAC Name: 2-[[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoyl]amino]acetic acid Traditional Name: 2-[[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acryloyl]amino]acetic acid Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=CC(=O)NCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C(=O)NCC(=O)O

InChI

InChI=1S/C19H27NO4/c1-18(2,3)13-9-12(7-8-15(21)20-11-16(22)23)10-14(17(13)24)19(4,5)6/h7-10,24H,11H2,1-6H3,(H,20,21)(H,22,23)/b8-7+