(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-chloro-6-fluoro-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-fluoro-1-benzothiophene-2-carboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-fluoro-benzothiophene-2-carboxylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C23H12ClFO4S MolecularWeight: 438.855383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=C(C5=C(S4)C=C(C=C5)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=C(C5=C(S4)C=C(C=C5)F)Cl

InChI

InChI=1S/C23H12ClFO4S/c24-21-16-7-6-14(25)10-18(16)30-22(21)23(27)28-11-13-9-19(26)29-17-8-5-12-3-1-2-4-15(12)20(13)17/h1-10H,11H2