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

Systemtic Name: (2-methylphenyl)methyl 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate Openeye Name: o-tolylmethyl 3,6-dichlorobenzothiophene-2-carboxylate CAS Name: 3,6-dichloro-1-benzothiophene-2-carboxylic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 3,6-dichloro-1-benzothiophene-2-carboxylate Traditional Name: 3,6-dichlorobenzothiophene-2-carboxylic acid (2-methylbenzyl) ester Formula: C17H12Cl2O2S MolecularWeight: 351.24698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H12Cl2O2S/c1-10-4-2-3-5-11(10)9-21-17(20)16-15(19)13-7-6-12(18)8-14(13)22-16/h2-8H,9H2,1H3