2-phosphonooxyethyl 3-(5-chloranyl-2-methoxy-phenyl)-3-fluoranyl-2-oxidanylidene-6-(trifluoromethyl)indole-1-carboxylate

Systemtic Name: 2-phosphonooxyethyl 3-(5-chloranyl-2-methoxy-phenyl)-3-fluoranyl-2-oxidanylidene-6-(trifluoromethyl)indole-1-carboxylate Openeye Name: 2-phosphonooxyethyl 3-(5-chloro-2-methoxy-phenyl)-3-fluoro-2-oxo-6-(trifluoromethyl)indoline-1-carboxylate CAS Name: 3-(5-chloro-2-methoxyphenyl)-3-fluoro-2-oxo-6-(trifluoromethyl)-1-indolecarboxylic acid 2-phosphonooxyethyl ester IUPAC Name: 2-phosphonooxyethyl 3-(5-chloro-2-methoxyphenyl)-3-fluoro-2-oxo-6-(trifluoromethyl)indole-1-carboxylate Traditional Name: 3-(5-chloro-2-methoxy-phenyl)-3-fluoro-2-keto-6-(trifluoromethyl)indoline-1-carboxylic acid 2-phosphonooxyethyl ester Formula: C19H15ClF4NO8P MolecularWeight: 527.744674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2(C3=C(C=C(C=C3)C(F)(F)F)N(C2=O)C(=O)OCCOP(=O)(O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2(C3=C(C=C(C=C3)C(F)(F)F)N(C2=O)C(=O)OCCOP(=O)(O)O)F

InChI

InChI=1S/C19H15ClF4NO8P/c1-31-15-5-3-11(20)9-13(15)18(21)12-4-2-10(19(22,23)24)8-14(12)25(16(18)26)17(27)32-6-7-33-34(28,29)30/h2-5,8-9H,6-7H2,1H3,(H2,28,29,30)