2-[4-[(E)-3-(3-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxy-6-prop-2-enylphenoxy]acetic acid
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![2-[4-[(E)-3-(3-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxy-6-prop-2-enylphenoxy]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/56fc34d1fb7f455684e79e065faa8495.png "2-[4-[(E)-3-(3-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxy-6-prop-2-enylphenoxy]acetic acid")
2-[4-[(E)-3-(3-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxy-6-prop-2-enylphenoxy]acetic acid
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CAS No:
348575-55-3
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Formula:
C23H21BrN2O5
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Chemical Name:
2-[4-[(E)-3-(3-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxy-6-prop-2-enylphenoxy]acetic acid
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Synonyms:
[4-{(1E)-3-[(3-bromophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2-ethoxy-6-(prop-2-en-1-yl)phenoxy]acetic acid;ZINC2414374;STK179440;AKOS003217665;348575-55-3
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CAS No:
2-[4-[(E)-3-(3-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxy-6-prop-2-enylphenoxy]acetic acid Basic Attributes
485.3 g/mol
484.06338 g/mol
Computed Properties
Molecular Weight:485.3
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:484.06338
Monoisotopic Mass:484.06338
Topological Polar Surface Area:109
Heavy Atom Count:31
Complexity:716
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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