2-[(E)-2-(3-sulfanylphenyl)ethenyl]benzoic acid

Systemtic Name: 2-[(E)-2-(3-sulfanylphenyl)ethenyl]benzoic acid Openeye Name: 2-[(E)-2-(3-sulfanylphenyl)vinyl]benzoic acid CAS Name: 2-[(E)-2-(3-mercaptophenyl)ethenyl]benzoic acid IUPAC Name: 2-[(E)-2-(3-sulfanylphenyl)ethenyl]benzoic acid Traditional Name: 2-[(E)-2-(3-mercaptophenyl)vinyl]benzoic acid Formula: C15H12O2S MolecularWeight: 256.31958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC2=CC(=CC=C2)S)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C2=CC(=CC=C2)S)C(=O)O

InChI

InChI=1S/C15H12O2S/c16-15(17)14-7-2-1-5-12(14)9-8-11-4-3-6-13(18)10-11/h1-10,18H,(H,16,17)/b9-8+