[4-(2-methylpropoxycarbonyl)phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [4-(2-methylpropoxycarbonyl)phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (4-isobutoxycarbonylphenyl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [4-[2-methylpropoxy(oxo)methyl]phenyl] ester IUPAC Name: [4-(2-methylpropoxycarbonyl)phenyl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (4-isobutoxycarbonylphenyl) ester Formula: C20H17ClO4S MolecularWeight: 388.86458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClO4S/c1-12(2)11-24-19(22)13-7-9-14(10-8-13)25-20(23)18-17(21)15-5-3-4-6-16(15)26-18/h3-10,12H,11H2,1-2H3