(5-methyl-1H-pyrazol-3-yl)-[(5R)-9-phenethyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)N2CCC3(C2)CCC[NH+](C3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1)C(=O)N2CC[C@@]3(C2)CCC[NH+](C3)CCC4=CC=CC=C4

InChI

InChI=1S/C21H28N4O/c1-17-14-19(23-22-17)20(26)25-13-10-21(16-25)9-5-11-24(15-21)12-8-18-6-3-2-4-7-18/h2-4,6-7,14H,5,8-13,15-16H2,1H3,(H,22,23)/p+1/t21-/m0/s1