8-[(1,3-diphenylpyrazol-4-yl)methyl]-4-methyl-4-aza-8-azoniaspiro[4.5]decan-3-one

Systemtic Name: 8-[(1,3-diphenylpyrazol-4-yl)methyl]-4-methyl-4-aza-8-azoniaspiro[4.5]decan-3-one Openeye Name: 8-[(1,3-diphenylpyrazol-4-yl)methyl]-4-methyl-4-aza-8-azoniaspiro[4.5]decan-3-one CAS Name: 8-[(1,3-diphenyl-4-pyrazolyl)methyl]-4-methyl-4-aza-8-azoniaspiro[4.5]decan-3-one IUPAC Name: 8-[(1,3-diphenylpyrazol-4-yl)methyl]-4-methyl-4-aza-8-azoniaspiro[4.5]decan-3-one Traditional Name: 8-[(1,3-diphenylpyrazol-4-yl)methyl]-4-methyl-4-aza-8-azoniaspiro[4.5]decan-3-one Formula: C25H29N4O+ MolecularWeight: 401.52396

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CCC12CC[NH+](CC2)CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)CCC12CC[NH+](CC2)CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H28N4O/c1-27-23(30)12-13-25(27)14-16-28(17-15-25)18-21-19-29(22-10-6-3-7-11-22)26-24(21)20-8-4-2-5-9-20/h2-11,19H,12-18H2,1H3/p+1