2-[(E)-2-(3-methoxy-4-propan-2-yloxy-phenyl)ethenyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[(E)-2-(3-methoxy-4-propan-2-yloxy-phenyl)ethenyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[(E)-2-(4-isopropoxy-3-methoxy-phenyl)vinyl]thiazole-4-carboxylic acid CAS Name: 2-[(E)-2-(3-methoxy-4-propan-2-yloxyphenyl)ethenyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[(E)-2-(3-methoxy-4-propan-2-yloxyphenyl)ethenyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[(E)-2-(4-isopropoxy-3-methoxy-phenyl)vinyl]thiazole-4-carboxylic acid Formula: C16H17NO4S MolecularWeight: 319.37548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C=CC2=NC(=CS2)C(=O)O)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)/C=C/C2=NC(=CS2)C(=O)O)OC

InChI

InChI=1S/C16H17NO4S/c1-10(2)21-13-6-4-11(8-14(13)20-3)5-7-15-17-12(9-22-15)16(18)19/h4-10H,1-3H3,(H,18,19)/b7-5+