2-[[2-methoxy-5-[(E)-3-phenylprop-2-enoyl]phenyl]methylsulfanyl]ethanoate

Systemtic Name: 2-[[2-methoxy-5-[(E)-3-phenylprop-2-enoyl]phenyl]methylsulfanyl]ethanoate Openeye Name: 2-[[2-methoxy-5-[(E)-3-phenylprop-2-enoyl]phenyl]methylsulfanyl]acetate CAS Name: 2-[[2-methoxy-5-[(E)-1-oxo-3-phenylprop-2-enyl]phenyl]methylthio]acetate IUPAC Name: 2-[[2-methoxy-5-[(E)-3-phenylprop-2-enoyl]phenyl]methylsulfanyl]acetate Traditional Name: 2-[[2-methoxy-5-[(E)-3-phenylacryloyl]benzyl]thio]acetate Formula: C19H17O4S- MolecularWeight: 341.40088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC=CC=C2)CSCC(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C=C/C2=CC=CC=C2)CSCC(=O)[O-]

InChI

InChI=1S/C19H18O4S/c1-23-18-10-8-15(11-16(18)12-24-13-19(21)22)17(20)9-7-14-5-3-2-4-6-14/h2-11H,12-13H2,1H3,(H,21,22)/p-1/b9-7+