methyl 4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate

Systemtic Name: methyl 4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate Openeye Name: methyl 4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate CAS Name: 4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylic acid methyl ester IUPAC Name: methyl 4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate Traditional Name: 4,5,6,7-tetrahydroisobenzothiophene-1-carboxylic acid methyl ester Formula: C10H12O2S MolecularWeight: 196.26608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2CCCCC2=CS1

Isomeric SMILES

COC(=O)C1=C2CCCCC2=CS1

InChI

InChI=1S/C10H12O2S/c1-12-10(11)9-8-5-3-2-4-7(8)6-13-9/h6H,2-5H2,1H3