(2,3,6-trimethylphenyl) 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate

Systemtic Name: (2,3,6-trimethylphenyl) 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate Openeye Name: (2,3,6-trimethylphenyl) 3,6-dichlorobenzothiophene-2-carboxylate CAS Name: 3,6-dichloro-1-benzothiophene-2-carboxylic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 3,6-dichloro-1-benzothiophene-2-carboxylate Traditional Name: 3,6-dichlorobenzothiophene-2-carboxylic acid (2,3,6-trimethylphenyl) ester Formula: C18H14Cl2O2S MolecularWeight: 365.27356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C18H14Cl2O2S/c1-9-4-5-10(2)16(11(9)3)22-18(21)17-15(20)13-7-6-12(19)8-14(13)23-17/h4-8H,1-3H3