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904874-86-8

904874-86-8 structural image
Product Name: (E)-4-OXO-4-[4-(1-PYRROLIDINYLCARBONYL)ANILINO]-2-BUTENOIC ACID
Formula: C15H16N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 288.30 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 288.11100700 g/mol
Monoisotopic Mass 288.11100700 g/mol
Topological Polar Surface Area 86.7 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 433
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes