(E)-3-(5-cyano-2-methoxy-phenyl)prop-2-enethioic S-acid

Systemtic Name: (E)-3-(5-cyano-2-methoxy-phenyl)prop-2-enethioic S-acid Openeye Name: (E)-3-(5-cyano-2-methoxy-phenyl)prop-2-enethioic S-acid CAS Name: (E)-3-(5-cyano-2-methoxyphenyl)-2-propenethioic S-acid IUPAC Name: (E)-3-(5-cyano-2-methoxyphenyl)prop-2-enethioic S-acid Traditional Name: (E)-3-(5-cyano-2-methoxy-phenyl)thioacrylic acid Formula: C11H9NO2S MolecularWeight: 219.25966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C#N)C=CC(=O)S

Isomeric SMILES

COC1=C(C=C(C=C1)C#N)/C=C/C(=O)S

InChI

InChI=1S/C11H9NO2S/c1-14-10-4-2-8(7-12)6-9(10)3-5-11(13)15/h2-6H,1H3,(H,13,15)/b5-3+