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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1)CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4)C.Cl

Isomeric SMILES

CC1=C(N(N=C1)CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4)C.Cl

InChI

InChI=1S/C22H22N2O2.ClH/c1-16-14-23-24(17(16)2)15-20-13-22(21(25)26-20,18-9-5-3-6-10-18)19-11-7-4-8-12-19;/h3-12,14,20H,13,15H2,1-2H3;1H