2-[[5-[(E)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-enoyl]-2-methoxy-phenyl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[5-[(E)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-enoyl]-2-methoxy-phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[5-[(E)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-enoyl]-2-methoxy-phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[5-[(E)-3-(3-ethoxy-2-propoxyphenyl)-1-oxoprop-2-enyl]-2-methoxyphenyl]methylthio]acetic acid IUPAC Name: 2-[[5-[(E)-3-(3-ethoxy-2-propoxyphenyl)prop-2-enoyl]-2-methoxyphenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[5-[(E)-3-(3-ethoxy-2-propoxy-phenyl)acryloyl]-2-methoxy-benzyl]thio]acetic acid Formula: C24H28O6S MolecularWeight: 444.54052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC=C1OCC)C=CC(=O)C2=CC(=C(C=C2)OC)CSCC(=O)O

Isomeric SMILES

CCCOC1=C(C=CC=C1OCC)/C=C/C(=O)C2=CC(=C(C=C2)OC)CSCC(=O)O

InChI

InChI=1S/C24H28O6S/c1-4-13-30-24-17(7-6-8-22(24)29-5-2)9-11-20(25)18-10-12-21(28-3)19(14-18)15-31-16-23(26)27/h6-12,14H,4-5,13,15-16H2,1-3H3,(H,26,27)/b11-9+