Benzeneacetic acid, α-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [3(R)-endo]-, sulfate (2:1) (salt)
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![Benzeneacetic acid, α-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [3(R)-endo]-, sulfate (2:1) (salt) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/81c5205e82894f89953aa4146592aa42.png "Benzeneacetic acid, α-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [3(R)-endo]-, sulfate (2:1) (salt)")
Benzeneacetic acid, α-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [3(R)-endo]-, sulfate (2:1) (salt)
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CAS No:
300-40-3
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Formula:
C17H23NO3.1/2H2O4S
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Chemical Name:
Benzeneacetic acid, α-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [3(R)-endo]-, sulfate (2:1) (salt)
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Synonyms:
Benzeneacetic acid,α-(hydroxymethyl)-,8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester,[3(R)-endo]-,sulfate (2:1) (salt);1αH,5αH-Tropan-3α-ol,(-)-tropate (ester),sulfate (2:1)
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CAS No:
Benzeneacetic acid, α-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [3(R)-endo]-, sulfate (2:1) (salt) Basic Attributes
676.823
676.303
Computed Properties
Molecular Weight:676.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:10
Exact Mass:676.30296691
Monoisotopic Mass:676.30296691
Topological Polar Surface Area:183
Heavy Atom Count:47
Complexity:434
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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