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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC2=C(C1)C=C(S2)C(C3CCCCC3)O

Isomeric SMILES

COC(=O)C1CCC2=C(C1)C=C(S2)C(C3CCCCC3)O

InChI

InChI=1S/C17H24O3S/c1-20-17(19)12-7-8-14-13(9-12)10-15(21-14)16(18)11-5-3-2-4-6-11/h10-12,16,18H,2-9H2,1H3