4-[(E)-3-[4-(1,3-thiazol-2-yl)phenyl]prop-2-enoyl]benzoic acid

Systemtic Name: 4-[(E)-3-[4-(1,3-thiazol-2-yl)phenyl]prop-2-enoyl]benzoic acid Openeye Name: 4-[(E)-3-(4-thiazol-2-ylphenyl)prop-2-enoyl]benzoic acid CAS Name: 4-[(E)-1-oxo-3-[4-(2-thiazolyl)phenyl]prop-2-enyl]benzoic acid IUPAC Name: 4-[(E)-3-[4-(1,3-thiazol-2-yl)phenyl]prop-2-enoyl]benzoic acid Traditional Name: 4-[(E)-3-(4-thiazol-2-ylphenyl)acryloyl]benzoic acid Formula: C19H13NO3S MolecularWeight: 335.37642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=CC=C(C=C2)C(=O)O)C3=NC=CS3

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)C2=CC=C(C=C2)C(=O)O)C3=NC=CS3

InChI

InChI=1S/C19H13NO3S/c21-17(14-6-8-16(9-7-14)19(22)23)10-3-13-1-4-15(5-2-13)18-20-11-12-24-18/h1-12H,(H,22,23)/b10-3+