Chem
J-GLOBAL ID:200907083734080058
Nikkaji number:J2.314.830G
2-[(S)-α-(tert-Butoxycarbonylamino)-4-methylbenzyl]malonic acid dimethyl ester
2-[(S)-α-(tert-ブトキシカルボニルアミノ)-4-メチルベンジル]マロン酸ジメチル
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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:
C18 H25 NO6
Molecular formula furigana:
C18-H25-N-O6
Molecular weight:
351.399
InChI:
InChI=1S/C18H25NO6/c1-11-7-9-12(10-8-11)14(19-17(22)25-18(2,3)4)13(15(20)23-5)16(21)24-6/h7-10,13-14H,1-6H3,(H,19,22)/t14-/m1/s1
InChI key:
QROQVFDRMXJCAL-CQSZACIVSA-N
SMILES:
COC(=O)C([C@H](NC(=O)OC(C)(C)C)c1ccc(C)cc1)C(=O)OC
Systematic name (4):
2-[(S)-α-(tert-ブトキシカルボニルアミノ)-4-メチルベンジル]マロン酸ジメチル
[(S)-α-[(tert-ブチルオキシカルボニル)アミノ]-4-メチルベンジル]マロン酸ジメチル
1,3-ジメチル 2-[(S)-{[(tert-ブトキシ)カルボニル]アミノ}(4-メチルフェニル)メチル]プロパンジオアート
1,3-dimethyl 2-[(S)-{[(tert-butoxy)carbonyl]amino}(4-methylphenyl)methyl]propanedioate
Other name (2):
2-[(S)-α-(tert-Butoxycarbonylamino)-4-methylbenzyl]malonic acid dimethyl ester
[(S)-α-[(tert-Butyloxycarbonyl)amino]-4-methylbenzyl]malonic acid dimethyl ester
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