4-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]-7-oxidanylidene-chromen-2-yl]amino]benzoate

Systemtic Name: 4-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]-7-oxidanylidene-chromen-2-yl]amino]benzoate Openeye Name: 4-[[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]-7-oxo-chromen-2-yl]amino]benzoate CAS Name: 4-[[3-[(3-chloro-4-fluoroanilino)-oxomethyl]-7-oxo-1-benzopyran-2-yl]amino]benzoate IUPAC Name: 4-[[3-[(3-chloro-4-fluorophenyl)carbamoyl]-7-oxochromen-2-yl]amino]benzoate Traditional Name: 4-[[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]-7-keto-chromen-2-yl]amino]benzoate Formula: C23H13ClFN2O5- MolecularWeight: 451.811123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])NC2=C(C=C3C=CC(=O)C=C3O2)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])NC2=C(C=C3C=CC(=O)C=C3O2)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C23H14ClFN2O5/c24-18-10-15(6-8-19(18)25)26-21(29)17-9-13-3-7-16(28)11-20(13)32-22(17)27-14-4-1-12(2-5-14)23(30)31/h1-11,27H,(H,26,29)(H,30,31)/p-1