(4-tert-butylphenyl)methyl 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate

Systemtic Name: (4-tert-butylphenyl)methyl 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate Openeye Name: (4-tert-butylphenyl)methyl 3,6-dichlorobenzothiophene-2-carboxylate CAS Name: 3,6-dichloro-1-benzothiophene-2-carboxylic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 3,6-dichloro-1-benzothiophene-2-carboxylate Traditional Name: 3,6-dichlorobenzothiophene-2-carboxylic acid (4-tert-butylbenzyl) ester Formula: C20H18Cl2O2S MolecularWeight: 393.32672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H18Cl2O2S/c1-20(2,3)13-6-4-12(5-7-13)11-24-19(23)18-17(22)15-9-8-14(21)10-16(15)25-18/h4-10H,11H2,1-3H3