Chem
J-GLOBAL ID：200907095899866380   Nikkaji number：J917.153C

(S)-6-Methyloctanoic 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 (6S)-6-メチルオクタノアート
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： C28H31NO4
Molecular formula furigana： C28-H31-N-O4
Molecular weight： 445.559
InChI： InChI=1S/C28H31NO4/c1-4-18(2)9-5-8-12-26(30)33-17-19(3)29-27(31)24-15-22-13-20-10-6-7-11-21(20)14-23(22)16-25(24)28(29)32/h6-7,10-11,13-16,18-19H,4-5,8-9,12,17H2,1-3H3/t18-,19-/m0/s1
InChI key： CLLUSKMDJXGDOS-OALUTQOASA-N
SMILES： CC[C@H](C)CCCCC(=O)OC[C@H](C)N1C(=O)c2cc3cc4ccccc4cc3cc2C1=O
Systematic name  (3)：
  • (S)-6-メチルオクタン酸(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 (6S)-6-メチルオクタノアート
  • (2S)-2-{1,3-dioxo-1H,2H,3H-naphtho[2,3-f]isoindol-2-yl}propyl (6S)-6-methyloctanoate
Other name (1)：
  • (S)-6-Methyloctanoic 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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