(2Z)-2-cyano-2-[5-hydroxy-7-(4-nitrophenyl)-1,3-benzoxathiol-2-ylidene]acetamide
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![(2Z)-2-cyano-2-[5-hydroxy-7-(4-nitrophenyl)-1,3-benzoxathiol-2-ylidene]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/c896d9ff15124c6f8dfb16571f27af08.png "(2Z)-2-cyano-2-[5-hydroxy-7-(4-nitrophenyl)-1,3-benzoxathiol-2-ylidene]acetamide")
(2Z)-2-cyano-2-[5-hydroxy-7-(4-nitrophenyl)-1,3-benzoxathiol-2-ylidene]acetamide
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CAS No:
496799-36-1
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Formula:
C16H9N3O5S
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Chemical Name:
(2Z)-2-cyano-2-[5-hydroxy-7-(4-nitrophenyl)-1,3-benzoxathiol-2-ylidene]acetamide
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Synonyms:
Oprea1_592810;C16H9N3O5S;STL181419;ZINC13596701;AKOS001693073;(2Z)-2-cyano-2-[5-hydroxy-7-(4-nitrophenyl)-1,3-benzoxathiol-2-ylidene]acetamide;SR-01000085221;SR-01000085221-1;(2Z)-2-cyano-2-[5-hydroxy-7-(4-nitrophenyl)-1,3-benzoxathiol-2-ylidene]ethanamide;496799-36-1
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CAS No:
(2Z)-2-cyano-2-[5-hydroxy-7-(4-nitrophenyl)-1,3-benzoxathiol-2-ylidene]acetamide Basic Attributes
355.3 g/mol
355.02629157 g/mol
Computed Properties
Molecular Weight:355.3
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:355.02629157
Monoisotopic Mass:355.02629157
Topological Polar Surface Area:168
Heavy Atom Count:25
Complexity:644
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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