Chem
J-GLOBAL ID：202007018244470232   Nikkaji number：J3.749.907B

(1S,8aR)-1-(4-methoxyphenyl)-3-methyl-4,5,6,7,8,8a-hexahydro-1H-azulen-2-one

(1S,8aR)-1-(4-メトキシフェニル)-3-メチル-4,5,6,7,8,8a-ヘキサヒドロ-1H-アズレン-2-オン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C18H22O2
Molecular formula furigana： C18-H22-O2
Molecular weight： 270.372
InChI： InChI=1S/C18H22O2/c1-12-15-6-4-3-5-7-16(15)17(18(12)19)13-8-10-14(20-2)11-9-13/h8-11,16-17H,3-7H2,1-2H3/t16-,17+/m0/s1
InChI key： VTFDWKNQDIFLIK-DLBZAZTESA-N
SMILES： C1CCC2=C(C(=O)[C@@H]([C@H]2CC1)c1ccc(cc1)OC)C
Systematic name  (3)：
  • (3S,3aR)-1-メチル-3-(4-メトキシフェニル)-3a,4,5,6,7,8-ヘキサヒドロアズレン-2(3H)-オン
  • (1S,8aR)-1-(4-メトキシフェニル)-3-メチル-1,2,4,5,6,7,8,8a-オクタヒドロアズレン-2-オン
  • (1S,8aR)-1-(4-methoxyphenyl)-3-methyl-1,2,4,5,6,7,8,8a-octahydroazulen-2-one
Other name (2)：
  • (1S,8aR)-1-(4-メトキシフェニル)-3-メチル-4,5,6,7,8,8a-ヘキサヒドロ-1H-アズレン-2-オン
  • (1S,8aR)-1-(4-methoxyphenyl)-3-methyl-4,5,6,7,8,8a-hexahydro-1H-azulen-2-one
Thsaurus map：
Thesaurus Map

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