5-[(Z)-2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-methoxybenzoic acid
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![5-[(Z)-2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-methoxybenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ce820bd5c31549b4bb0b0e4487473033.png "5-[(Z)-2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-methoxybenzoic acid")
5-[(Z)-2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-methoxybenzoic acid
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CAS No:
5740-33-0
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Formula:
C20H18N2O4
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Chemical Name:
5-[(Z)-2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-methoxybenzoic acid
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Synonyms:
MLS000703210;CHEMBL1584780;HMS2655J07;ZINC4974055;AKOS000611671;SMR000273674;ST50338956;5-{(1Z)-2-cyano-2-[N-(4-ethylphenyl)carbamoyl]vinyl}-2-methoxybenzoic acid;5740-33-0
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CAS No:
5-[(Z)-2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-methoxybenzoic acid Basic Attributes
350.4 g/mol
350.12665706 g/mol
Computed Properties
Molecular Weight:350.4
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:350.12665706
Monoisotopic Mass:350.12665706
Topological Polar Surface Area:99.4
Heavy Atom Count:26
Complexity:584
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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