3-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]benzoic acid
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![3-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/569d5b88e1bb40bbbe5221306db6ea19.png "3-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]benzoic acid")
3-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]benzoic acid
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CAS No:
19056-85-0
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Formula:
C15H17NO6
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Chemical Name:
3-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]benzoic acid
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Synonyms:
CBMicro_001690;3-((3-ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-en-1-yl)amino)benzoic acid;3-{[3-ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-en-1-yl]amino}benzoic acid;CHEMBL599681;SMSF0015663;ZINC1780078;MFCD02081805;STL331298;AKOS001615291;CB03136;MCULE-8129290166;BIM-0001731.P001;ST50189849;3-{[2,2-bis(ethoxycarbonyl)vinyl]amino}benzoic acid;F3095-4379;3-{[3-ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-enyl]amino}benzoic acid;19056-85-0
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CAS No:
3-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]benzoic acid Basic Attributes
307.30 g/mol
307.10558726 g/mol
Computed Properties
Molecular Weight:307.30
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:307.10558726
Monoisotopic Mass:307.10558726
Topological Polar Surface Area:102
Heavy Atom Count:22
Complexity:425
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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