2-methoxyethyl (E)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enoate

Systemtic Name: 2-methoxyethyl (E)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enoate Openeye Name: 2-methoxyethyl (E)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-[4-(methylthio)phenyl]-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (E)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(methylthio)phenyl]acrylic acid 2-methoxyethyl ester Formula: C14H15NO3S MolecularWeight: 277.3388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(=CC1=CC=C(C=C1)SC)C#N

Isomeric SMILES

COCCOC(=O)/C(=C/C1=CC=C(C=C1)SC)/C#N

InChI

InChI=1S/C14H15NO3S/c1-17-7-8-18-14(16)12(10-15)9-11-3-5-13(19-2)6-4-11/h3-6,9H,7-8H2,1-2H3/b12-9+