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75370-49-9

75370-49-9 structural image
Product Name: 3H-7,13b-Methano(1,3)benzodioxolo(5,6-e)(2)benzazocin-3-one, 5,6,7,8-t etrahydro-2-methoxy-, hydrochloride, (+-)-, hydrate (2:2:1)
Formula: C18H17NO4.ClH.H2O
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COMPUTED DESCRIPTORS

Molecular Weight 347.8 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 347.0924357 g/mol
Monoisotopic Mass 347.0924357 g/mol
Topological Polar Surface Area 56.8 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 612
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes