(3S)-3-(2,5-dimethoxyphenyl)-3-oxidanyl-pentanoate

Systemtic Name: (3S)-3-(2,5-dimethoxyphenyl)-3-oxidanyl-pentanoate Openeye Name: (3S)-3-(2,5-dimethoxyphenyl)-3-hydroxy-pentanoate CAS Name: (3S)-3-(2,5-dimethoxyphenyl)-3-hydroxypentanoate IUPAC Name: (3S)-3-(2,5-dimethoxyphenyl)-3-hydroxypentanoate Traditional Name: (3S)-3-(2,5-dimethoxyphenyl)-3-hydroxy-valerate Formula: C13H17O5- MolecularWeight: 253.27108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)[O-])(C1=C(C=CC(=C1)OC)OC)O

Isomeric SMILES

CC[C@](CC(=O)[O-])(C1=C(C=CC(=C1)OC)OC)O

InChI

InChI=1S/C13H18O5/c1-4-13(16,8-12(14)15)10-7-9(17-2)5-6-11(10)18-3/h5-7,16H,4,8H2,1-3H3,(H,14,15)/p-1/t13-/m0/s1