methyl 2-[cyclohexyl(oxidanyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[cyclohexyl(oxidanyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[cyclohexyl(hydroxy)methyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[cyclohexyl(hydroxy)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[cyclohexyl(hydroxy)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[cyclohexyl(hydroxy)methyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C17H24O3S MolecularWeight: 308.43566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCCC2)C(C3CCCCC3)O

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCCC2)C(C3CCCCC3)O

InChI

InChI=1S/C17H24O3S/c1-20-17(19)14-12-9-5-6-10-13(12)21-16(14)15(18)11-7-3-2-4-8-11/h11,15,18H,2-10H2,1H3