(2,6-dimethylphenyl) 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (2,6-dimethylphenyl) 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (2,6-dimethylphenyl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (2,6-dimethylphenyl) ester Formula: C17H13ClO2S MolecularWeight: 316.80192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H13ClO2S/c1-10-6-5-7-11(2)15(10)20-17(19)16-14(18)12-8-3-4-9-13(12)21-16/h3-9H,1-2H3