2-(1-phenacyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)-N-phenyl-N-propan-2-yl-ethanamide dichloride

Systemtic Name: 2-(1-phenacyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)-N-phenyl-N-propan-2-yl-ethanamide dichloride Openeye Name: N-isopropyl-2-(1-phenacyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)-N-phenyl-acetamide dichloride CAS Name: 2-(1-phenacyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)-N-phenyl-N-propan-2-ylacetamide dichloride IUPAC Name: 2-(1-phenacyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)-N-phenyl-N-propan-2-ylacetamide dichloride Traditional Name: N-isopropyl-2-(1-phenacyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)-N-phenyl-acetamide dichloride Formula: C25H33Cl2N3O2 MolecularWeight: 478.45442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)C[N+]23CC[N+](CC2)(CC3)CC(=O)C4=CC=CC=C4.[Cl-].[Cl-]

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)C[N+]23CC[N+](CC2)(CC3)CC(=O)C4=CC=CC=C4.[Cl-].[Cl-]

InChI

InChI=1S/C25H33N3O2.2ClH/c1-21(2)26(23-11-7-4-8-12-23)25(30)20-28-16-13-27(14-17-28,15-18-28)19-24(29)22-9-5-3-6-10-22;;/h3-12,21H,13-20H2,1-2H3;2*1H/q+2;;/p-2