Chem
J-GLOBAL ID：200907089984965185
Nikkaji number：J1.690.747B
(S)-(4-Methoxyanilino)[(1S)-2-oxocyclohexyl]acetic acid ethyl ester
(S)-(4-メトキシアニリノ)[(1S)-2-オキソシクロヘキシル]酢酸エチル
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
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
Molecular formula： C17H23NO4
Molecular formula furigana： C17-H23-N-O4
Molecular weight： 305.374
InChI：
InChI=1S/C17H23NO4/c1-3-22-17(20)16(14-6-4-5-7-15(14)19)18-12-8-10-13(21-2)11-9-12/h8-11,14,16,18H,3-7H2,1-2H3/t14-,16+/m1/s1
InChI key：
CGFHPAOZHLNPMX-ZBFHGGJFSA-N
SMILES：
CCOC(=O)[C@@H](Nc1ccc(OC)cc1)[C@@H]1CCCCC1=O
Systematic name (11)：
- (αS,1S)-α-(4-メトキシフェニルアミノ)-2-オキソシクロヘキサン-1β-酢酸エチル
- (2S)-N-(4-メトキシフェニル)-2-[(S)-2-オキソシクロヘキサン-1β-イル]グリシンエチル
- (S)-[(4-メトキシフェニル)アミノ](2-オキソシクロヘキサン-1β-イル)酢酸エチル
- (2S)-2-(4-メトキシアニリノ)-2-[(1S)-2-オキソシクロヘキサン-1-イル]酢酸エチル
- (2S)-2-(4-メトキシアニリノ)-2-[(1S)-2-オキソシクロヘキシル]酢酸エチル
Show all
- (αS,1S)-α-(4-Methoxyphenylamino)-2-oxocyclohexane-1β-acetic acid ethyl ester
- (2S)-N-(4-Methoxyphenyl)-2-[(S)-2-oxocyclohexane-1β-yl]glycine ethyl ester
- (S)-[(4-Methoxyphenyl)amino](2-oxocyclohexane-1β-yl)acetic acid ethyl ester
- (2S)-2-(4-Methoxyanilino)-2-[(1S)-2-oxocyclohexane-1-yl]acetic acid ethyl ester
- (2S)-2-(4-Methoxyanilino)-2-[(1S)-2-oxocyclohexyl]acetic acid ethyl ester
Show all
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