2-(3-butoxy-4-methoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-(3-butoxy-4-methoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(3-butoxy-4-methoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-(3-butoxy-4-methoxyphenyl)-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(3-butoxy-4-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(3-butoxy-4-methoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid Formula: C16H19NO4S MolecularWeight: 321.39136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C2=NC(=C(S2)C(=O)O)C)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)C2=NC(=C(S2)C(=O)O)C)OC

InChI

InChI=1S/C16H19NO4S/c1-4-5-8-21-13-9-11(6-7-12(13)20-3)15-17-10(2)14(22-15)16(18)19/h6-7,9H,4-5,8H2,1-3H3,(H,18,19)