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

Systemtic Name: 5-[(2-ethyl-3-methyl-pyrazol-1-ium-1-yl)methyl]-3,3-diphenyl-oxolan-2-one chloride Openeye Name: 5-[(2-ethyl-3-methyl-pyrazol-1-ium-1-yl)methyl]-3,3-diphenyl-tetrahydrofuran-2-one chloride CAS Name: 5-[(2-ethyl-3-methyl-1-pyrazol-1-iumyl)methyl]-3,3-diphenyl-2-oxolanone chloride IUPAC Name: 5-[(2-ethyl-3-methylpyrazol-1-ium-1-yl)methyl]-3,3-diphenyloxolan-2-one chloride Traditional Name: 5-[(2-ethyl-3-methyl-pyrazol-1-ium-1-yl)methyl]-3,3-diphenyl-tetrahydrofuran-2-one chloride Formula: C23H25ClN2O2 MolecularWeight: 396.9098

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=[N+]1CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Cl-]

Isomeric SMILES

CCN1C(=CC=[N+]1CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Cl-]

InChI

InChI=1S/C23H25N2O2.ClH/c1-3-25-18(2)14-15-24(25)17-21-16-23(22(26)27-21,19-10-6-4-7-11-19)20-12-8-5-9-13-20;/h4-15,21H,3,16-17H2,1-2H3;1H/q+1;/p-1