(2-oxidanylidene-7-phenyl-1,3-benzoxathiol-5-yl) 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (2-oxidanylidene-7-phenyl-1,3-benzoxathiol-5-yl) 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (2-oxo-7-phenyl-1,3-benzoxathiol-5-yl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid (2-oxo-7-phenyl-1,3-benzoxathiol-5-yl) ester IUPAC Name: (2-oxo-7-phenyl-1,3-benzoxathiol-5-yl) 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (2-keto-7-phenyl-1,3-benzoxathiol-5-yl) ester Formula: C22H11ClO4S2 MolecularWeight: 438.90334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C22H11ClO4S2/c23-18-14-8-4-5-9-16(14)28-20(18)21(24)26-13-10-15(12-6-2-1-3-7-12)19-17(11-13)29-22(25)27-19/h1-11H