2-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]isoquinolin-1-one hydrochloride

Systemtic Name: 2-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]isoquinolin-1-one hydrochloride Openeye Name: 2-[(3S)-quinuclidin-3-yl]isoquinolin-1-one hydrochloride CAS Name: 2-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-1-isoquinolinone hydrochloride IUPAC Name: 2-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]isoquinolin-1-one hydrochloride Traditional Name: 2-[(3S)-quinuclidin-3-yl]isocarbostyril hydrochloride Formula: C16H19ClN2O MolecularWeight: 290.78786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)N3C=CC4=CC=CC=C4C3=O.Cl

Isomeric SMILES

C1CN2CCC1[C@@H](C2)N3C=CC4=CC=CC=C4C3=O.Cl

InChI

InChI=1S/C16H18N2O.ClH/c19-16-14-4-2-1-3-12(14)7-10-18(16)15-11-17-8-5-13(15)6-9-17;/h1-4,7,10,13,15H,5-6,8-9,11H2;1H/t15-;/m1./s1