5-[(2,4-dimethylpyrazol-2-ium-1-yl)methyl]-3,3-diphenyl-oxolan-2-one chloride

Systemtic Name: 5-[(2,4-dimethylpyrazol-2-ium-1-yl)methyl]-3,3-diphenyl-oxolan-2-one chloride Openeye Name: 5-[(2,4-dimethylpyrazol-2-ium-1-yl)methyl]-3,3-diphenyl-tetrahydrofuran-2-one chloride CAS Name: 5-[(2,4-dimethyl-1-pyrazol-2-iumyl)methyl]-3,3-diphenyl-2-oxolanone chloride IUPAC Name: 5-[(2,4-dimethylpyrazol-2-ium-1-yl)methyl]-3,3-diphenyloxolan-2-one chloride Traditional Name: 5-[(2,4-dimethylpyrazol-2-ium-1-yl)methyl]-3,3-diphenyl-tetrahydrofuran-2-one chloride Formula: C22H23ClN2O2 MolecularWeight: 382.88322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN([N+](=C1)C)CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC1=CN([N+](=C1)C)CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C22H23N2O2.ClH/c1-17-14-23(2)24(15-17)16-20-13-22(21(25)26-20,18-9-5-3-6-10-18)19-11-7-4-8-12-19;/h3-12,14-15,20H,13,16H2,1-2H3;1H/q+1;/p-1