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

Systemtic Name: 4-[(E)-3-methoxy-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-methoxy-3-oxo-2-(4-phenylthiazol-2-yl)prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-methoxy-3-oxo-2-(4-phenyl-2-thiazolyl)prop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-methoxy-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)prop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-keto-3-methoxy-2-(4-phenylthiazol-2-yl)prop-1-enyl]benzoic acid Formula: C20H15NO4S MolecularWeight: 365.4024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=C(C=C1)C(=O)O)C2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)/C(=C\C1=CC=C(C=C1)C(=O)O)/C2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H15NO4S/c1-25-20(24)16(11-13-7-9-15(10-8-13)19(22)23)18-21-17(12-26-18)14-5-3-2-4-6-14/h2-12H,1H3,(H,22,23)/b16-11-