(E)-but-2-enedioate; (3R)-3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane

Systemtic Name: (E)-but-2-enedioate; (3R)-3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane Openeye Name: (E)-but-2-enedioate; (3R)-3-prop-2-ynoxyquinuclidine CAS Name: (E)-2-butenedioate; (3R)-3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane IUPAC Name: (E)-but-2-enedioate; (3R)-3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane Traditional Name: (3R)-3-propargyloxyquinuclidine fumarate Formula: C14H17NO5-2 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1CN2CCC1CC2.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C#CCO[C@H]1CN2CCC1CC2.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C10H15NO.C4H4O4/c1-2-7-12-10-8-11-5-3-9(10)4-6-11;5-3(6)1-2-4(7)8/h1,9-10H,3-8H2;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1+/t10-;/m0./s1