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

Systemtic Name: 3,3-diphenyl-5-[[2-(phenylmethyl)imidazol-1-yl]methyl]oxolan-2-one hydrochloride Openeye Name: 5-[(2-benzylimidazol-1-yl)methyl]-3,3-diphenyl-tetrahydrofuran-2-one hydrochloride CAS Name: 3,3-diphenyl-5-[[2-(phenylmethyl)-1-imidazolyl]methyl]-2-oxolanone hydrochloride IUPAC Name: 5-[(2-benzylimidazol-1-yl)methyl]-3,3-diphenyloxolan-2-one hydrochloride Traditional Name: 5-[(2-benzylimidazol-1-yl)methyl]-3,3-diphenyl-tetrahydrofuran-2-one hydrochloride Formula: C27H25ClN2O2 MolecularWeight: 444.9526

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C1(C2=CC=CC=C2)C3=CC=CC=C3)CN4C=CN=C4CC5=CC=CC=C5.Cl

Isomeric SMILES

C1C(OC(=O)C1(C2=CC=CC=C2)C3=CC=CC=C3)CN4C=CN=C4CC5=CC=CC=C5.Cl

InChI

InChI=1S/C27H24N2O2.ClH/c30-26-27(22-12-6-2-7-13-22,23-14-8-3-9-15-23)19-24(31-26)20-29-17-16-28-25(29)18-21-10-4-1-5-11-21;/h1-17,24H,18-20H2;1H