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

Systemtic Name: (2S)-3-[2-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propanoate Openeye Name: (2S)-3-[2-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenyl-propanoate CAS Name: (2S)-3-[2-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenylpropanoate IUPAC Name: (2S)-3-[2-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]-2-phenylpropanoate Traditional Name: (2S)-3-[2-[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=C2CC(C3=CC=CC=C3)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCOC2=CC=CC=C2C[C@@H](C3=CC=CC=C3)C(=O)[O-])C

InChI

InChI=1S/C25H26O4/c1-18-12-13-23(19(2)16-18)28-14-15-29-24-11-7-6-10-21(24)17-22(25(26)27)20-8-4-3-5-9-20/h3-13,16,22H,14-15,17H2,1-2H3,(H,26,27)/p-1/t22-/m0/s1