ethyl 7-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 7-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 7-[(2-chloro-4-fluoro-phenyl)methoxy]-3-(3,4-dimethoxyphenyl)-4-oxo-chromene-2-carboxylate CAS Name: 7-[(2-chloro-4-fluorophenyl)methoxy]-3-(3,4-dimethoxyphenyl)-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[(2-chloro-4-fluorophenyl)methoxy]-3-(3,4-dimethoxyphenyl)-4-oxochromene-2-carboxylate Traditional Name: 7-(2-chloro-4-fluoro-benzyl)oxy-3-(3,4-dimethoxyphenyl)-4-keto-chromene-2-carboxylic acid ethyl ester Formula: C27H22ClFO7 MolecularWeight: 512.910783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OCC3=C(C=C(C=C3)F)Cl)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OCC3=C(C=C(C=C3)F)Cl)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H22ClFO7/c1-4-34-27(31)26-24(15-6-10-21(32-2)23(11-15)33-3)25(30)19-9-8-18(13-22(19)36-26)35-14-16-5-7-17(29)12-20(16)28/h5-13H,4,14H2,1-3H3