1-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-pyrazol-1-yl-ethanone

Systemtic Name: 1-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-pyrazol-1-yl-ethanone Openeye Name: 1-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-pyrazol-1-yl-ethanone CAS Name: 1-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-(1-pyrazolyl)ethanone IUPAC Name: 1-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-pyrazol-1-ylethanone Traditional Name: 1-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-pyrazol-1-yl-ethanone Formula: C21H29N4O+ MolecularWeight: 353.48116

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCN(C2)C(=O)CN3C=CC=N3)C[NH+](C1)CCC4=CC=CC=C4

Isomeric SMILES

C1C[C@]2(CCN(C2)C(=O)CN3C=CC=N3)C[NH+](C1)CCC4=CC=CC=C4

InChI

InChI=1S/C21H28N4O/c26-20(16-25-13-5-11-22-25)24-15-10-21(18-24)9-4-12-23(17-21)14-8-19-6-2-1-3-7-19/h1-3,5-7,11,13H,4,8-10,12,14-18H2/p+1/t21-/m0/s1