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

Systemtic Name: (2S)-2-methoxy-3-[4-[3-(4-phenylphenoxy)prop-1-ynoxy]phenyl]propanoic acid Openeye Name: (2S)-2-methoxy-3-[4-[3-(4-phenylphenoxy)prop-1-ynoxy]phenyl]propanoic acid CAS Name: (2S)-2-methoxy-3-[4-[3-(4-phenylphenoxy)prop-1-ynoxy]phenyl]propanoic acid IUPAC Name: (2S)-2-methoxy-3-[4-[3-(4-phenylphenoxy)prop-1-ynoxy]phenyl]propanoic acid Traditional Name: (2S)-2-methoxy-3-[4-[3-(4-phenylphenoxy)prop-1-ynoxy]phenyl]propionic acid Formula: C25H22O5 MolecularWeight: 402.43918

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=CC=C(C=C1)OC#CCOC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CO[C@@H](CC1=CC=C(C=C1)OC#CCOC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H22O5/c1-28-24(25(26)27)18-19-8-12-22(13-9-19)29-16-5-17-30-23-14-10-21(11-15-23)20-6-3-2-4-7-20/h2-4,6-15,24H,17-18H2,1H3,(H,26,27)/t24-/m0/s1