4-[(3S,5S)-5-methyl-1,2,4-trioxolan-3-yl]butanal

Systemtic Name: 4-[(3S,5S)-5-methyl-1,2,4-trioxolan-3-yl]butanal Openeye Name: 4-[(3S,5S)-5-methyl-1,2,4-trioxolan-3-yl]butanal CAS Name: 4-[(3S,5S)-5-methyl-1,2,4-trioxolan-3-yl]butanal IUPAC Name: 4-[(3S,5S)-5-methyl-1,2,4-trioxolan-3-yl]butanal Traditional Name: 4-[(3S,5S)-5-methyl-1,2,4-trioxolan-3-yl]butyraldehyde Formula: C7H12O4 MolecularWeight: 160.16778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1OC(OO1)CCCC=O

Isomeric SMILES

C[C@H]1O[C@@H](OO1)CCCC=O

InChI

InChI=1S/C7H12O4/c1-6-9-7(11-10-6)4-2-3-5-8/h5-7H,2-4H2,1H3/t6-,7-/m0/s1