1-[(2S,4S,6S)-2-phenyl-6-(3-phenylmethoxypropyl)-1,3-dioxan-4-yl]pent-4-en-2-one

Systemtic Name: 1-[(2S,4S,6S)-2-phenyl-6-(3-phenylmethoxypropyl)-1,3-dioxan-4-yl]pent-4-en-2-one Openeye Name: 1-[(2S,4S,6S)-6-(3-benzyloxypropyl)-2-phenyl-1,3-dioxan-4-yl]pent-4-en-2-one CAS Name: 1-[(2S,4S,6S)-2-phenyl-6-(3-phenylmethoxypropyl)-1,3-dioxan-4-yl]-4-penten-2-one IUPAC Name: 1-[(2S,4S,6S)-2-phenyl-6-(3-phenylmethoxypropyl)-1,3-dioxan-4-yl]pent-4-en-2-one Traditional Name: 1-[(2S,4S,6S)-6-(3-benzoxypropyl)-2-phenyl-1,3-dioxan-4-yl]pent-4-en-2-one Formula: C25H30O4 MolecularWeight: 394.5033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(=O)CC1CC(OC(O1)C2=CC=CC=C2)CCCOCC3=CC=CC=C3

Isomeric SMILES

C=CCC(=O)C[C@@H]1C[C@@H](O[C@@H](O1)C2=CC=CC=C2)CCCOCC3=CC=CC=C3

InChI

InChI=1S/C25H30O4/c1-2-10-22(26)17-24-18-23(28-25(29-24)21-13-7-4-8-14-21)15-9-16-27-19-20-11-5-3-6-12-20/h2-8,11-14,23-25H,1,9-10,15-19H2/t23-,24+,25-/m0/s1