(2S)-3-[3-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propanoate

Systemtic Name: (2S)-3-[3-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propanoate Openeye Name: (2S)-3-[3-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propanoate CAS Name: (2S)-3-[3-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]-2-phenylpropanoate IUPAC Name: (2S)-3-[3-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]-2-phenylpropanoate Traditional Name: (2S)-3-[3-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propionate Formula: C25H25O4- MolecularWeight: 389.4636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCCOC2=CC=CC(=C2)CC(C3=CC=CC=C3)C(=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)OCCOC2=CC=CC(=C2)C[C@@H](C3=CC=CC=C3)C(=O)[O-])C

InChI

InChI=1S/C25H26O4/c1-18-8-6-13-24(19(18)2)29-15-14-28-22-12-7-9-20(16-22)17-23(25(26)27)21-10-4-3-5-11-21/h3-13,16,23H,14-15,17H2,1-2H3,(H,26,27)/p-1/t23-/m0/s1