(2-chloranyl-6-fluoranyl-phenyl)methyl 3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanoate CAS Name: 3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)propanoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoate Traditional Name: 3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propionic acid (2-chloro-6-fluoro-benzyl) ester Formula: C21H18ClFO5 MolecularWeight: 404.816023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H18ClFO5/c1-12-14-7-6-13(26-2)10-19(14)28-21(25)15(12)8-9-20(24)27-11-16-17(22)4-3-5-18(16)23/h3-7,10H,8-9,11H2,1-2H3