(2S)-2-methoxy-3-[4-[4-(4-phenylphenoxy)but-1-ynoxy]phenyl]propanoic acid

Systemtic Name: (2S)-2-methoxy-3-[4-[4-(4-phenylphenoxy)but-1-ynoxy]phenyl]propanoic acid Openeye Name: (2S)-2-methoxy-3-[4-[4-(4-phenylphenoxy)but-1-ynoxy]phenyl]propanoic acid CAS Name: (2S)-2-methoxy-3-[4-[4-(4-phenylphenoxy)but-1-ynoxy]phenyl]propanoic acid IUPAC Name: (2S)-2-methoxy-3-[4-[4-(4-phenylphenoxy)but-1-ynoxy]phenyl]propanoic acid Traditional Name: (2S)-2-methoxy-3-[4-[4-(4-phenylphenoxy)but-1-ynoxy]phenyl]propionic acid Formula: C26H24O5 MolecularWeight: 416.46576

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=CC=C(C=C1)OC#CCCOC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CO[C@@H](CC1=CC=C(C=C1)OC#CCCOC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H24O5/c1-29-25(26(27)28)19-20-9-13-23(14-10-20)30-17-5-6-18-31-24-15-11-22(12-16-24)21-7-3-2-4-8-21/h2-4,7-16,25H,6,18-19H2,1H3,(H,27,28)/t25-/m0/s1