2-Azabicyclo[3.2.0]heptane-2-carboxylic acid, 7-amino-, (1S,5S,7S)-, 1,1-dimethylethyl ester, 4-methylbenzenesulfonate (1:1)

CAS Registry Number®

2331211-58-4
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CAS Name

2-Azabicyclo[3.2.0]heptane-2-carboxylic acid, 7-amino-, (1S,5S,7S)-, 1,1-dimethylethyl ester, 4-methylbenzenesulfonate (1:1)

Molecular Formula

C11H20N2O2.C7H8O3S

Cite this Page

2-Azabicyclo[3.2.0]heptane-2-carboxylic acid, 7-amino-, (1S,5S,7S)-, 1,1-dimethylethyl ester, 4-methylbenzenesulfonate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2331211-58-4 (retrieved 2024-09-11) (CAS RN: 2331211-58-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H20N2O2.C7H8O3S/c1-11(2,3)15-10(14)13-5-4-7-6-8(12)9(7)13;1-6-2-4-7(5-3-6)11(8,9)10/h7-9H,4-6,12H2,1-3H3;2-5H,1H3,(H,8,9,10)/t7-,8-,9-;/m0./s1

InChIKey

InChIKey=XTTIVNPBSMYSBR-YWUTZLAHSA-N

SMILES

C(OC(C)(C)C)(=O)N1[C@]2([C@](C[C@@H]2N)(CC1)[H])[H].S(=O)(=O)(O)C1=CC=C(C)C=C1

Canonical SMILES

O=C(OC(C)(C)C)N1CCC2CC(N)C12.O=S(=O)(O)C1=CC=C(C=C1)C

Other Names for this Substance

  • 2-Azabicyclo[3.2.0]heptane-2-carboxylic acid, 7-amino-, (1S,5S,7S)-, 1,1-dimethylethyl ester, 4-methylbenzenesulfonate (1:1)