(2,2,4,4-tetramethyl-3-oxidanyl-pentyl) 5-methoxy-1-benzothiophene-2-carboxylate

Systemtic Name: (2,2,4,4-tetramethyl-3-oxidanyl-pentyl) 5-methoxy-1-benzothiophene-2-carboxylate Openeye Name: (3-hydroxy-2,2,4,4-tetramethyl-pentyl) 5-methoxybenzothiophene-2-carboxylate CAS Name: 5-methoxy-1-benzothiophene-2-carboxylic acid (3-hydroxy-2,2,4,4-tetramethylpentyl) ester IUPAC Name: (3-hydroxy-2,2,4,4-tetramethylpentyl) 5-methoxy-1-benzothiophene-2-carboxylate Traditional Name: 5-methoxybenzothiophene-2-carboxylic acid (3-hydroxy-2,2,4,4-tetramethyl-pentyl) ester Formula: C19H26O4S MolecularWeight: 350.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(C)(C)COC(=O)C1=CC2=C(S1)C=CC(=C2)OC)O

Isomeric SMILES

CC(C)(C)C(C(C)(C)COC(=O)C1=CC2=C(S1)C=CC(=C2)OC)O

InChI

InChI=1S/C19H26O4S/c1-18(2,3)17(21)19(4,5)11-23-16(20)15-10-12-9-13(22-6)7-8-14(12)24-15/h7-10,17,21H,11H2,1-6H3