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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4)C.Cl

Isomeric SMILES

CC1=CC(=NN1CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4)C.Cl

InChI

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