3,3,5-trimethyl-5-[[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]hexanoic acid

Systemtic Name: 3,3,5-trimethyl-5-[[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]hexanoic acid Openeye Name: 5-[[(E)-4-hydroxy-4-oxo-but-2-enoyl]amino]-3,3,5-trimethyl-hexanoic acid CAS Name: 5-[[(E)-4-hydroxy-1,4-dioxobut-2-enyl]amino]-3,3,5-trimethylhexanoic acid IUPAC Name: 5-[[(E)-4-hydroxy-4-oxobut-2-enoyl]amino]-3,3,5-trimethylhexanoic acid Traditional Name: 5-[[(E)-4-hydroxy-4-keto-but-2-enoyl]amino]-3,3,5-trimethyl-hexanoic acid Formula: C13H21NO5 MolecularWeight: 271.30954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)O)CC(C)(C)NC(=O)C=CC(=O)O

Isomeric SMILES

CC(C)(CC(=O)O)CC(C)(C)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H21NO5/c1-12(2,7-11(18)19)8-13(3,4)14-9(15)5-6-10(16)17/h5-6H,7-8H2,1-4H3,(H,14,15)(H,16,17)(H,18,19)/b6-5+