Chem
J-GLOBAL ID:200907007798910609
Nikkaji number:J2.295.035E
(2S)-2-[(2,4-Dinitrophenylsulfonyl)propargylamino]-3-(1H-indole-3-yl)propanoic acid methyl ester
(2S)-2-[(2,4-ジニトロフェニルスルホニル)プロパルギルアミノ]-3-(1H-インドール-3-イル)プロパン酸メチル
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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:
C21 H18 N2 [N+]2 O6 [O-]2 S
Molecular formula furigana:
C21-H18-N4-O8-S
Molecular weight:
486.460
InChI:
InChI=1S/C21H18N4O8S/c1-3-10-23(34(31,32)20-9-8-15(24(27)28)12-18(20)25(29)30)19(21(26)33-2)11-14-13-22-17-7-5-4-6-16(14)17/h1,4-9,12-13,19,22H,10-11H2,2H3/t19-/m0/s1
InChI key:
RFFYGZRRSLIYPD-IBGZPJMESA-N
SMILES:
COC(=O)[C@H](Cc1c[nH]c2ccccc12)N(CC#C)S(=O)(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
Systematic name (4):
(2S)-2-[プロパルギル[(2,4-ジニトロフェニル)スルホニル]アミノ]-3-(1H-インドール-3-イル)プロピオン酸メチル
(2S)-2-[(2,4-ジニトロフェニルスルホニル)プロパルギルアミノ]-3-(1H-インドール-3-イル)プロパン酸メチル
メチル (2S)-3-(1H-インドール-3-イル)-2-[N-(プロパ-2-イン-1-イル)2,4-ジニトロベンゼンスルホンアミド]プロパノアート
methyl (2S)-3-(1H-indol-3-yl)-2-[N-(prop-2-yn-1-yl)2,4-dinitrobenzenesulfonamido]propanoate
Other name (2):
(2S)-2-[Propargyl[(2,4-dinitrophenyl)sulfonyl]amino]-3-(1H-indole-3-yl)propionic acid methyl ester
(2S)-2-[(2,4-Dinitrophenylsulfonyl)propargylamino]-3-(1H-indole-3-yl)propanoic acid methyl ester
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