Chem
J-GLOBAL ID：200907023228479829   Nikkaji number：J917.149E

(S)-4-Methylhexanoic acid (S)-2-[(1,3-dioxo-2,3-dihydro-1H-naphth[2,3-f]isoindol)-2-yl]propyl ester

(2S)-2-{1,3-ジオキソ-1H,2H,3H-ナフト[2,3-f]イソインドール-2-イル}プロピル (4S)-4-メチルヘキサノアート
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： C26H27NO4
Molecular formula furigana： C26-H27-N-O4
Molecular weight： 417.505
InChI： InChI=1S/C26H27NO4/c1-4-16(2)9-10-24(28)31-15-17(3)27-25(29)22-13-20-11-18-7-5-6-8-19(18)12-21(20)14-23(22)26(27)30/h5-8,11-14,16-17H,4,9-10,15H2,1-3H3/t16-,17-/m0/s1
InChI key： JLCRCLNBBDDRKL-IRXDYDNUSA-N
SMILES： CC[C@H](C)CCC(=O)OC[C@H](C)N1C(=O)c2cc3cc4ccccc4cc3cc2C1=O
Systematic name  (3)：
  • (S)-4-メチルヘキサン酸(S)-2-[(1,3-ジオキソ-2,3-ジヒドロ-1H-ナフト[2,3-f]イソインドール)-2-イル]プロピル
  • (2S)-2-{1,3-ジオキソ-1H,2H,3H-ナフト[2,3-f]イソインドール-2-イル}プロピル (4S)-4-メチルヘキサノアート
  • (2S)-2-{1,3-dioxo-1H,2H,3H-naphtho[2,3-f]isoindol-2-yl}propyl (4S)-4-methylhexanoate
Other name (1)：
  • (S)-4-Methylhexanoic acid (S)-2-[(1,3-dioxo-2,3-dihydro-1H-naphth[2,3-f]isoindol)-2-yl]propyl ester
Thsaurus map：
Thesaurus Map

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