3-[[(E)-2-cyano-3-(2-ethoxyphenyl)prop-2-enoyl]amino]benzoic acid
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![3-[[(E)-2-cyano-3-(2-ethoxyphenyl)prop-2-enoyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2078fa35f4c746fcab1e2bc7cdf43f8a.png "3-[[(E)-2-cyano-3-(2-ethoxyphenyl)prop-2-enoyl]amino]benzoic acid")
3-[[(E)-2-cyano-3-(2-ethoxyphenyl)prop-2-enoyl]amino]benzoic acid
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CAS No:
522656-95-7
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Formula:
C19H16N2O4
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Chemical Name:
3-[[(E)-2-cyano-3-(2-ethoxyphenyl)prop-2-enoyl]amino]benzoic acid
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Synonyms:
MLS000774005;CHEMBL1408248;HMS2753G08;522656-95-7;ZINC3255520;3-[[(E)-2-cyano-3-(2-ethoxyphenyl)prop-2-enoyl]amino]benzoic acid;AKOS001054660;SMR000364825
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CAS No:
3-[[(E)-2-cyano-3-(2-ethoxyphenyl)prop-2-enoyl]amino]benzoic acid Basic Attributes
336.3 g/mol
336.11100700 g/mol
Computed Properties
Molecular Weight:336.3
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:336.11100700
Monoisotopic Mass:336.11100700
Topological Polar Surface Area:99.4
Heavy Atom Count:25
Complexity:563
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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