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

Systemtic Name: (2S)-2-methoxy-3-[4-[3-[4-(phenylcarbonyl)phenoxy]prop-1-ynoxy]phenyl]propanoic acid Openeye Name: (2S)-3-[4-[3-(4-benzoylphenoxy)prop-1-ynoxy]phenyl]-2-methoxy-propanoic acid CAS Name: (2S)-3-[4-[3-(4-benzoylphenoxy)prop-1-ynoxy]phenyl]-2-methoxypropanoic acid IUPAC Name: (2S)-3-[4-[3-(4-benzoylphenoxy)prop-1-ynoxy]phenyl]-2-methoxypropanoic acid Traditional Name: (2S)-3-[4-[3-(4-benzoylphenoxy)prop-1-ynoxy]phenyl]-2-methoxy-propionic acid Formula: C26H22O6 MolecularWeight: 430.44928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22O6/c1-30-24(26(28)29)18-19-8-12-22(13-9-19)31-16-5-17-32-23-14-10-21(11-15-23)25(27)20-6-3-2-4-7-20/h2-4,6-15,24H,17-18H2,1H3,(H,28,29)/t24-/m0/s1