phenyl (3S)-3-[(4R,5S)-2,2-dimethyl-4-pentyl-1,3-dioxan-5-yl]-3-oxidanyl-propanoate

Systemtic Name: phenyl (3S)-3-[(4R,5S)-2,2-dimethyl-4-pentyl-1,3-dioxan-5-yl]-3-oxidanyl-propanoate Openeye Name: phenyl (3S)-3-[(4R,5S)-2,2-dimethyl-4-pentyl-1,3-dioxan-5-yl]-3-hydroxy-propanoate CAS Name: (3S)-3-[(4R,5S)-2,2-dimethyl-4-pentyl-1,3-dioxan-5-yl]-3-hydroxypropanoic acid phenyl ester IUPAC Name: phenyl (3S)-3-[(4R,5S)-2,2-dimethyl-4-pentyl-1,3-dioxan-5-yl]-3-hydroxypropanoate Traditional Name: (3S)-3-[(4R,5S)-4-amyl-2,2-dimethyl-1,3-dioxan-5-yl]-3-hydroxy-propionic acid phenyl ester Formula: C20H30O5 MolecularWeight: 350.4492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(COC(O1)(C)C)C(CC(=O)OC2=CC=CC=C2)O

Isomeric SMILES

CCCCC[C@@H]1[C@@H](COC(O1)(C)C)[C@H](CC(=O)OC2=CC=CC=C2)O

InChI

InChI=1S/C20H30O5/c1-4-5-7-12-18-16(14-23-20(2,3)25-18)17(21)13-19(22)24-15-10-8-6-9-11-15/h6,8-11,16-18,21H,4-5,7,12-14H2,1-3H3/t16-,17-,18+/m0/s1