(2S)-3-[3-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propanoate

Systemtic Name: (2S)-3-[3-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propanoate Openeye Name: (2S)-3-[3-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propanoate CAS Name: (2S)-3-[3-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenylpropanoate IUPAC Name: (2S)-3-[3-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenylpropanoate Traditional Name: (2S)-3-[3-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propionate Formula: C25H25O4- MolecularWeight: 389.4636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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