3-chloranyl-2-cyclopentyl-5-(4-fluoranyl-2-methyl-phenyl)-6-oxidanyl-pyran-4-one

Systemtic Name: 3-chloranyl-2-cyclopentyl-5-(4-fluoranyl-2-methyl-phenyl)-6-oxidanyl-pyran-4-one Openeye Name: 3-chloro-2-cyclopentyl-5-(4-fluoro-2-methyl-phenyl)-6-hydroxy-pyran-4-one CAS Name: 3-chloro-2-cyclopentyl-5-(4-fluoro-2-methylphenyl)-6-hydroxy-4-pyranone IUPAC Name: 3-chloro-2-cyclopentyl-5-(4-fluoro-2-methylphenyl)-6-hydroxypyran-4-one Traditional Name: 3-chloro-2-cyclopentyl-5-(4-fluoro-2-methyl-phenyl)-6-hydroxy-pyran-4-one Formula: C17H16ClFO3 MolecularWeight: 322.758543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2=C(OC(=C(C2=O)Cl)C3CCCC3)O

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2=C(OC(=C(C2=O)Cl)C3CCCC3)O

InChI

InChI=1S/C17H16ClFO3/c1-9-8-11(19)6-7-12(9)13-15(20)14(18)16(22-17(13)21)10-4-2-3-5-10/h6-8,10,21H,2-5H2,1H3