(4aR,4bS,6aS,7R,10aS,10bR)-8-chloranyl-6a-methyl-7-oxidanyl-1-(trifluoromethyl)-3,4,4a,4b,5,6,7,10,10a,10b,11,12-dodecahydrochrysen-2-one

Systemtic Name: (4aR,4bS,6aS,7R,10aS,10bR)-8-chloranyl-6a-methyl-7-oxidanyl-1-(trifluoromethyl)-3,4,4a,4b,5,6,7,10,10a,10b,11,12-dodecahydrochrysen-2-one Openeye Name: (4aR,4bS,6aS,7R,10aS,10bR)-8-chloro-7-hydroxy-6a-methyl-1-(trifluoromethyl)-3,4,4a,4b,5,6,7,10,10a,10b,11,12-dodecahydrochrysen-2-one CAS Name: (4aR,4bS,6aS,7R,10aS,10bR)-8-chloro-7-hydroxy-6a-methyl-1-(trifluoromethyl)-3,4,4a,4b,5,6,7,10,10a,10b,11,12-dodecahydrochrysen-2-one IUPAC Name: (4aR,4bS,6aS,7R,10aS,10bR)-8-chloro-7-hydroxy-6a-methyl-1-(trifluoromethyl)-3,4,4a,4b,5,6,7,10,10a,10b,11,12-dodecahydrochrysen-2-one Traditional Name: (4aR,4bS,6aS,7R,10aS,10bR)-8-chloro-7-hydroxy-6a-methyl-1-(trifluoromethyl)-3,4,4a,4b,5,6,7,10,10a,10b,11,12-dodecahydrochrysen-2-one Formula: C20H24ClF3O2 MolecularWeight: 388.85157

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CC=C(C2O)Cl)CCC4=C(C(=O)CCC34)C(F)(F)F

Isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC=C([C@@H]2O)Cl)CCC4=C(C(=O)CC[C@H]34)C(F)(F)F

InChI

InChI=1S/C20H24ClF3O2/c1-19-9-8-11-10-4-7-16(25)17(20(22,23)24)13(10)3-2-12(11)14(19)5-6-15(21)18(19)26/h6,10-12,14,18,26H,2-5,7-9H2,1H3/t10-,11-,12-,14+,18+,19+/m1/s1