(2-tert-butylphenyl) 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (2-tert-butylphenyl) 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (2-tert-butylphenyl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid (2-tert-butylphenyl) ester IUPAC Name: (2-tert-butylphenyl) 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (2-tert-butylphenyl) ester Formula: C19H17ClO2S MolecularWeight: 344.85508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C19H17ClO2S/c1-19(2,3)13-9-5-6-10-14(13)22-18(21)17-16(20)12-8-4-7-11-15(12)23-17/h4-11H,1-3H3