5-chloranyl-2-[2-(3-chloranyl-4-propan-2-yloxy-phenyl)ethyl]-2-cyclopentyl-6-oxidanyl-3H-pyran-4-one

Systemtic Name: 5-chloranyl-2-[2-(3-chloranyl-4-propan-2-yloxy-phenyl)ethyl]-2-cyclopentyl-6-oxidanyl-3H-pyran-4-one Openeye Name: 5-chloro-2-[2-(3-chloro-4-isopropoxy-phenyl)ethyl]-2-cyclopentyl-6-hydroxy-3H-pyran-4-one CAS Name: 5-chloro-2-[2-(3-chloro-4-propan-2-yloxyphenyl)ethyl]-2-cyclopentyl-6-hydroxy-3H-pyran-4-one IUPAC Name: 5-chloro-2-[2-(3-chloro-4-propan-2-yloxyphenyl)ethyl]-2-cyclopentyl-6-hydroxy-3H-pyran-4-one Traditional Name: 5-chloro-2-[2-(3-chloro-4-isopropoxy-phenyl)ethyl]-2-cyclopentyl-6-hydroxy-3H-pyran-4-one Formula: C21H26Cl2O4 MolecularWeight: 413.33474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CCC2(CC(=O)C(=C(O2)O)Cl)C3CCCC3)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CCC2(CC(=O)C(=C(O2)O)Cl)C3CCCC3)Cl

InChI

InChI=1S/C21H26Cl2O4/c1-13(2)26-18-8-7-14(11-16(18)22)9-10-21(15-5-3-4-6-15)12-17(24)19(23)20(25)27-21/h7-8,11,13,15,25H,3-6,9-10,12H2,1-2H3