3-(4-chloranyl-3-methyl-phenoxy)-4-oxidanyl-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 3-(4-chloranyl-3-methyl-phenoxy)-4-oxidanyl-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 3-(4-chloro-3-methyl-phenoxy)-4-hydroxy-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 3-(4-chloro-3-methylphenoxy)-4-hydroxy-2-(trifluoromethyl)-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 3-(4-chloro-3-methylphenoxy)-4-hydroxy-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 3-(4-chloro-3-methyl-phenoxy)-4-hydroxy-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one Formula: C17H14ClF3O4 MolecularWeight: 374.73887

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(OC3CC(=O)CCC3=C2O)C(F)(F)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(OC3CC(=O)CCC3=C2O)C(F)(F)F)Cl

InChI

InChI=1S/C17H14ClF3O4/c1-8-6-10(3-5-12(8)18)24-15-14(23)11-4-2-9(22)7-13(11)25-16(15)17(19,20)21/h3,5-6,13,23H,2,4,7H2,1H3