ethyl 2-(cyclohexylsulfanylmethyl)-5-oxidanyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-(cyclohexylsulfanylmethyl)-5-oxidanyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-(cyclohexylsulfanylmethyl)-5-hydroxy-benzofuran-3-carboxylate CAS Name: 2-[(cyclohexylthio)methyl]-5-hydroxy-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-(cyclohexylsulfanylmethyl)-5-hydroxy-1-benzofuran-3-carboxylate Traditional Name: 2-[(cyclohexylthio)methyl]-5-hydroxy-benzofuran-3-carboxylic acid ethyl ester Formula: C18H22O4S MolecularWeight: 334.42988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CSC3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CSC3CCCCC3

InChI

InChI=1S/C18H22O4S/c1-2-21-18(20)17-14-10-12(19)8-9-15(14)22-16(17)11-23-13-6-4-3-5-7-13/h8-10,13,19H,2-7,11H2,1H3