[2-(3-bromoanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate
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[2-(3-bromoanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate
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CAS No:
736164-48-0
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Formula:
C14H11BrN2O4
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Chemical Name:
[2-(3-bromoanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate
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Synonyms:
MLS002165189;CHEMBL1593391;HMS3003B21;ZINC3328917;AKOS033647468;SMR001247556;AB00719013-01;SR-01000044464;SR-01000044464-1;Z18882809;4-({[(3-bromophenyl)carbamoyl]methoxy}carbonyl)pyridin-1-ium-1-olate;736164-48-0
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CAS No:
[2-(3-bromoanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate Basic Attributes
351.15 g/mol
349.99022 g/mol
Computed Properties
Molecular Weight:351.15
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:349.99022
Monoisotopic Mass:349.99022
Topological Polar Surface Area:80.9
Heavy Atom Count:21
Complexity:372
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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