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Ethyl (7E)-2-[(2-chlorobenzoyl)amino]-7-(hydroxyimino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 1gXj2uvKAto
InChI InChI=1S/C18H17ClN2O4S/c1-2-25-18(23)14-11-7-5-9-13(21-24)15(11)26-17(14)20-16(22)10-6-3-4-8-12(10)19/h3-4,6,8,24H,2,5,7,9H2,1H3,(H,20,22)/b21-13+
InChIKey UAMVBTRCGVPUDI-FYJGNVAPSA-N
Mol Weight 392.86 g/mol
Molecular Formula C18H17ClN2O4S
Exact Mass 392.059756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KcagmRfz8hQ
Name Ethyl (7E)-2-[(2-chlorobenzoyl)amino]-7-(hydroxyimino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS Registry Number 331760-65-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17ClN2O4S
InChI InChI=1S/C18H17ClN2O4S/c1-2-25-18(23)14-11-7-5-9-13(21-24)15(11)26-17(14)20-16(22)10-6-3-4-8-12(10)19/h3-4,6,8,24H,2,5,7,9H2,1H3,(H,20,22)/b21-13+
InChIKey UAMVBTRCGVPUDI-FYJGNVAPSA-N
Molecular Weight 392.857 g/mol
SMILES O\N=C/1CCCc2c(c(sc12)NC(c1c(Cl)cccc1)=O)C(=O)OCC
SPLASH splash10-000i-3900000000-ee12a6e80e185d25cd2f
Source of Spectrum AD-0-2532-0
Synonyms Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-(2-chlorobenzoylamino)-7-hydroximino-, ethyl ester
Wiley ID 1426686