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1-Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[[2-[4-(phenylmethyl)-1-piperidinyl]acetyl]amino]-, ethyl ester
SpectraBase Compound ID KtzmJP80ezJ
InChI InChI=1S/C25H32N2O3S/c1-2-30-25(29)23-20-10-6-7-11-21(20)31-24(23)26-22(28)17-27-14-12-19(13-15-27)16-18-8-4-3-5-9-18/h3-5,8-9,19H,2,6-7,10-17H2,1H3,(H,26,28)
InChIKey SAXXZXDOGDCOQK-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C25H32N2O3S
Exact Mass 440.213364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZfTGYlPoyj
Name 1-Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[[2-[4-(phenylmethyl)-1-piperidinyl]acetyl]amino]-, ethyl ester
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Formula C25H32N2O3S
InChI InChI=1S/C25H32N2O3S/c1-2-30-25(29)23-20-10-6-7-11-21(20)31-24(23)26-22(28)17-27-14-12-19(13-15-27)16-18-8-4-3-5-9-18/h3-5,8-9,19H,2,6-7,10-17H2,1H3,(H,26,28)
InChIKey SAXXZXDOGDCOQK-UHFFFAOYSA-N
Molecular Weight 440.602 g/mol
SMILES N(C(CN1CCC(CC1)Cc1ccccc1)=O)c1c(c2CCCCc2s1)C(OCC)=O
SPLASH splash10-000l-2910400000-643b5e416d63c6cb69a2
Source of Spectrum IY-1-4501-5
Synonyms 2-[[1-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester Ethyl 2-[[2-(4-benzylpiperidin-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Ethyl 2-[[2-(4-benzyl-1-piperidyl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Ethyl 2-[2-[4-(phenylmethyl)piperidin-1-yl]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Wiley ID 1652998