3-[[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]carbonyl]-1H-pyridazin-6-one

Systemtic Name: 3-[[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]carbonyl]-1H-pyridazin-6-one Openeye Name: 3-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decane-3-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[oxo-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]methyl]-1H-pyridazin-6-one IUPAC Name: 3-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decane-3-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decane-3-carbonyl]-1H-pyridazin-6-one Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCN(C2)C(=O)C3=NNC(=O)C=C3)C[NH+](C1)CCC4=CC=CC=C4

Isomeric SMILES

C1C[C@]2(CCN(C2)C(=O)C3=NNC(=O)C=C3)C[NH+](C1)CCC4=CC=CC=C4

InChI

InChI=1S/C21H26N4O2/c26-19-8-7-18(22-23-19)20(27)25-14-11-21(16-25)10-4-12-24(15-21)13-9-17-5-2-1-3-6-17/h1-3,5-8H,4,9-16H2,(H,23,26)/p+1/t21-/m0/s1