6-(2-imidazol-1-ylethoxy)-3-methyl-1-benzothiophene-2-carboxylic acid

Systemtic Name: 6-(2-imidazol-1-ylethoxy)-3-methyl-1-benzothiophene-2-carboxylic acid Openeye Name: 6-(2-imidazol-1-ylethoxy)-3-methyl-benzothiophene-2-carboxylic acid CAS Name: 6-[2-(1-imidazolyl)ethoxy]-3-methyl-1-benzothiophene-2-carboxylic acid IUPAC Name: 6-(2-imidazol-1-ylethoxy)-3-methyl-1-benzothiophene-2-carboxylic acid Traditional Name: 6-(2-imidazol-1-ylethoxy)-3-methyl-benzothiophene-2-carboxylic acid Formula: C15H14N2O3S MolecularWeight: 302.34826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=CC(=C2)OCCN3C=CN=C3)C(=O)O

Isomeric SMILES

CC1=C(SC2=C1C=CC(=C2)OCCN3C=CN=C3)C(=O)O

InChI

InChI=1S/C15H14N2O3S/c1-10-12-3-2-11(8-13(12)21-14(10)15(18)19)20-7-6-17-5-4-16-9-17/h2-5,8-9H,6-7H2,1H3,(H,18,19)