4,4-diphenyl-1-pyrrolidin-1-ium-1-yl-butan-2-one chloride

Systemtic Name: 4,4-diphenyl-1-pyrrolidin-1-ium-1-yl-butan-2-one chloride Openeye Name: 4,4-diphenyl-1-pyrrolidin-1-ium-1-yl-butan-2-one chloride CAS Name: 4,4-diphenyl-1-(1-pyrrolidin-1-iumyl)-2-butanone chloride IUPAC Name: 4,4-diphenyl-1-pyrrolidin-1-ium-1-ylbutan-2-one chloride Traditional Name: 4,4-diphenyl-1-pyrrolidin-1-ium-1-yl-butan-2-one chloride Formula: C20H24ClNO MolecularWeight: 329.86366

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1CC[NH+](C1)CC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H23NO.ClH/c22-19(16-21-13-7-8-14-21)15-20(17-9-3-1-4-10-17)18-11-5-2-6-12-18;/h1-6,9-12,20H,7-8,13-16H2;1H