[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate
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![[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7845e3d284bb45a3b52c8aa196b38652.png "[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate")
[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate
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CAS No:
749872-48-8
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Formula:
C18H18N2O6S
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Chemical Name:
[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate
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Synonyms:
SMR000248745;MLS000333987;ZINC2644093;AKOS033647380;Z18882054;4-[({[4-cyclopropyl-3-(ethoxycarbonyl)thiophen-2-yl]carbamoyl}methoxy)carbonyl]pyridin-1-ium-1-olate;749872-48-8
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CAS No:
[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate Basic Attributes
390.4 g/mol
390.08855747 g/mol
Computed Properties
Molecular Weight:390.4
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:390.08855747
Monoisotopic Mass:390.08855747
Topological Polar Surface Area:135
Heavy Atom Count:27
Complexity:562
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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