(E)-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[2-(4-chlorophenyl)thiazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[2-(4-chlorophenyl)-4-thiazolyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[2-(4-chlorophenyl)thiazol-4-yl]acrylic acid Formula: C12H8ClNO2S MolecularWeight: 265.71542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=CS2)C=CC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=CS2)/C=C/C(=O)O)Cl

InChI

InChI=1S/C12H8ClNO2S/c13-9-3-1-8(2-4-9)12-14-10(7-17-12)5-6-11(15)16/h1-7H,(H,15,16)/b6-5+