ethyl 7-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]-6-oxidanylidene-3-phenyl-7H-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 7-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]-6-oxidanylidene-3-phenyl-7H-1-benzothiophene-2-carboxylate Openeye Name: ethyl 6-oxo-3-phenyl-7-[4-[2-(p-tolylsulfonyloxy)ethoxy]phenyl]-7H-benzothiophene-2-carboxylate CAS Name: 7-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]-6-oxo-3-phenyl-7H-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]-6-oxo-3-phenyl-7H-1-benzothiophene-2-carboxylate Traditional Name: 6-keto-3-phenyl-7-[4-(2-tosyloxyethoxy)phenyl]-7H-benzothiophene-2-carboxylic acid ethyl ester Formula: C32H28O7S2 MolecularWeight: 588.69052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)C(C(=O)C=C2)C3=CC=C(C=C3)OCCOS(=O)(=O)C4=CC=C(C=C4)C)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)C(C(=O)C=C2)C3=CC=C(C=C3)OCCOS(=O)(=O)C4=CC=C(C=C4)C)C5=CC=CC=C5

InChI

InChI=1S/C32H28O7S2/c1-3-37-32(34)31-28(22-7-5-4-6-8-22)26-17-18-27(33)29(30(26)40-31)23-11-13-24(14-12-23)38-19-20-39-41(35,36)25-15-9-21(2)10-16-25/h4-18,29H,3,19-20H2,1-2H3