Chem
J-GLOBAL ID:200907045168557900
Nikkaji number:J2.565.129D
(3S)-2-Cyano-3-(4-methoxyphenyl)-3-(3-methylphenyl)propanoic acid methyl ester
(3S)-2-シアノ-3-(4-メトキシフェニル)-3-(3-メチルフェニル)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:
C19 H19 NO3
Molecular formula furigana:
C19-H19-N-O3
Molecular weight:
309.365
InChI:
InChI=1S/C19H19NO3/c1-13-5-4-6-15(11-13)18(17(12-20)19(21)23-3)14-7-9-16(22-2)10-8-14/h4-11,17-18H,1-3H3/t17?,18-/m0/s1
InChI key:
MYHBSSSGUODAKC-ZVAWYAOSSA-N
SMILES:
COC(=O)C(C#N)[C@@H](c1ccc(OC)cc1)c1cccc(C)c1
Systematic name (3):
(3S)-2-シアノ-3-(4-メトキシフェニル)-3-(3-メチルフェニル)プロパン酸メチル
メチル (3S)-2-シアノ-3-(4-メトキシフェニル)-3-(3-メチルフェニル)プロパノアート
methyl (3S)-2-cyano-3-(4-methoxyphenyl)-3-(3-methylphenyl)propanoate
Other name (1):
(3S)-2-Cyano-3-(4-methoxyphenyl)-3-(3-methylphenyl)propanoic acid methyl ester
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