3-[(2-methylcyclohexyl)oxymethyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[(2-methylcyclohexyl)oxymethyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[(2-methylcyclohexoxy)methyl]benzothiophene-2-carboxylic acid CAS Name: 3-[(2-methylcyclohexyl)oxymethyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[(2-methylcyclohexyl)oxymethyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[(2-methylcyclohexoxy)methyl]benzothiophene-2-carboxylic acid Formula: C17H20O3S MolecularWeight: 304.4039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1OCC2=C(SC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1CCCCC1OCC2=C(SC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H20O3S/c1-11-6-2-4-8-14(11)20-10-13-12-7-3-5-9-15(12)21-16(13)17(18)19/h3,5,7,9,11,14H,2,4,6,8,10H2,1H3,(H,18,19)