3-[[(E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]benzoic acid
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![3-[[(E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/c194759e8c144b20954820a6a12c643a.png "3-[[(E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]benzoic acid")
3-[[(E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]benzoic acid
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CAS No:
372179-64-1
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Formula:
C21H13N3O6
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Chemical Name:
3-[[(E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]benzoic acid
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Synonyms:
C21H13N3O6;ZINC2275555;STL327029;AKOS022132522;3-({(2E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)benzoic acid;372179-64-1
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CAS No:
3-[[(E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]benzoic acid Basic Attributes
403.3 g/mol
403.08043514 g/mol
Computed Properties
Molecular Weight:403.3
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:403.08043514
Monoisotopic Mass:403.08043514
Topological Polar Surface Area:149
Heavy Atom Count:30
Complexity:752
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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