(E)-4-[(2S,4R,5R)-2-methyl-5-oxidanyl-1,3-dioxan-4-yl]but-3-en-2-one

Systemtic Name: (E)-4-[(2S,4R,5R)-2-methyl-5-oxidanyl-1,3-dioxan-4-yl]but-3-en-2-one Openeye Name: (E)-4-[(2S,4R,5R)-5-hydroxy-2-methyl-1,3-dioxan-4-yl]but-3-en-2-one CAS Name: (E)-4-[(2S,4R,5R)-5-hydroxy-2-methyl-1,3-dioxan-4-yl]-3-buten-2-one IUPAC Name: (E)-4-[(2S,4R,5R)-5-hydroxy-2-methyl-1,3-dioxan-4-yl]but-3-en-2-one Traditional Name: (E)-4-[(2S,4R,5R)-5-hydroxy-2-methyl-1,3-dioxan-4-yl]but-3-en-2-one Formula: C9H14O4 MolecularWeight: 186.20506

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Descriptors Computed from Structure

Canonical SMILES:

CC1OCC(C(O1)C=CC(=O)C)O

Isomeric SMILES

C[C@H]1OC[C@H]([C@H](O1)/C=C/C(=O)C)O

InChI

InChI=1S/C9H14O4/c1-6(10)3-4-9-8(11)5-12-7(2)13-9/h3-4,7-9,11H,5H2,1-2H3/b4-3+/t7-,8+,9+/m0/s1