(E)-3-(6-phenylsulfanylpyridin-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(6-phenylsulfanylpyridin-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(6-phenylsulfanyl-3-pyridyl)prop-2-enoic acid CAS Name: (E)-3-[6-(phenylthio)-3-pyridinyl]-2-propenoic acid IUPAC Name: (E)-3-(6-phenylsulfanylpyridin-3-yl)prop-2-enoic acid Traditional Name: (E)-3-[6-(phenylthio)-3-pyridyl]acrylic acid Formula: C14H11NO2S MolecularWeight: 257.30764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NC=C(C=C2)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=NC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C14H11NO2S/c16-14(17)9-7-11-6-8-13(15-10-11)18-12-4-2-1-3-5-12/h1-10H,(H,16,17)/b9-7+