(4-propanoylphenyl) (E)-3-(4-methylsulfanylphenyl)prop-2-enoate

Systemtic Name: (4-propanoylphenyl) (E)-3-(4-methylsulfanylphenyl)prop-2-enoate Openeye Name: (4-propanoylphenyl) (E)-3-(4-methylsulfanylphenyl)prop-2-enoate CAS Name: (E)-3-[4-(methylthio)phenyl]-2-propenoic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) (E)-3-(4-methylsulfanylphenyl)prop-2-enoate Traditional Name: (E)-3-[4-(methylthio)phenyl]acrylic acid (4-propionylphenyl) ester Formula: C19H18O3S MolecularWeight: 326.40942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC(=O)C=CC2=CC=C(C=C2)SC

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC(=O)/C=C/C2=CC=C(C=C2)SC

InChI

InChI=1S/C19H18O3S/c1-3-18(20)15-7-9-16(10-8-15)22-19(21)13-6-14-4-11-17(23-2)12-5-14/h4-13H,3H2,1-2H3/b13-6+