(E)-2-methyl-5-phenyl-pent-4-enethioic S-acid

Systemtic Name: (E)-2-methyl-5-phenyl-pent-4-enethioic S-acid Openeye Name: (E)-2-methyl-5-phenyl-pent-4-enethioic S-acid CAS Name: (E)-2-methyl-5-phenyl-4-pentenethioic S-acid IUPAC Name: (E)-2-methyl-5-phenylpent-4-enethioic S-acid Traditional Name: (E)-2-methyl-5-phenyl-pent-4-enethioic S-acid Formula: C12H14OS MolecularWeight: 206.30396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC1=CC=CC=C1)C(=O)S

Isomeric SMILES

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

InChI

InChI=1S/C12H14OS/c1-10(12(13)14)6-5-9-11-7-3-2-4-8-11/h2-5,7-10H,6H2,1H3,(H,13,14)/b9-5+