2-(4-chloranyl-2,6-dimethyl-phenyl)-5-methyl-3-oxidanyl-3a,4,5,6,7,7a-hexahydroinden-1-one

Systemtic Name: 2-(4-chloranyl-2,6-dimethyl-phenyl)-5-methyl-3-oxidanyl-3a,4,5,6,7,7a-hexahydroinden-1-one Openeye Name: 2-(4-chloro-2,6-dimethyl-phenyl)-3-hydroxy-5-methyl-3a,4,5,6,7,7a-hexahydroinden-1-one CAS Name: 2-(4-chloro-2,6-dimethylphenyl)-3-hydroxy-5-methyl-3a,4,5,6,7,7a-hexahydroinden-1-one IUPAC Name: 2-(4-chloro-2,6-dimethylphenyl)-3-hydroxy-5-methyl-3a,4,5,6,7,7a-hexahydroinden-1-one Traditional Name: 2-(4-chloro-2,6-dimethyl-phenyl)-3-hydroxy-5-methyl-3a,4,5,6,7,7a-hexahydroinden-1-one Formula: C18H21ClO2 MolecularWeight: 304.81114

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2C(C1)C(=C(C2=O)C3=C(C=C(C=C3C)Cl)C)O

Isomeric SMILES

CC1CCC2C(C1)C(=C(C2=O)C3=C(C=C(C=C3C)Cl)C)O

InChI

InChI=1S/C18H21ClO2/c1-9-4-5-13-14(6-9)18(21)16(17(13)20)15-10(2)7-12(19)8-11(15)3/h7-9,13-14,21H,4-6H2,1-3H3