[3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-2-oxidanylidene-4-propyl-chromen-7-yl] 2-methoxyethanoate

Systemtic Name: [3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-2-oxidanylidene-4-propyl-chromen-7-yl] 2-methoxyethanoate Openeye Name: [3-[(2-chloro-6-fluoro-phenyl)methyl]-2-oxo-4-propyl-chromen-7-yl] 2-methoxyacetate CAS Name: 2-methoxyacetic acid [3-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-4-propyl-1-benzopyran-7-yl] ester IUPAC Name: [3-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-4-propylchromen-7-yl] 2-methoxyacetate Traditional Name: 2-methoxyacetic acid [3-(2-chloro-6-fluoro-benzyl)-2-keto-4-propyl-chromen-7-yl] ester Formula: C22H20ClFO5 MolecularWeight: 418.842603

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)COC)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCCC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)COC)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H20ClFO5/c1-3-5-14-15-9-8-13(28-21(25)12-27-2)10-20(15)29-22(26)16(14)11-17-18(23)6-4-7-19(17)24/h4,6-10H,3,5,11-12H2,1-2H3