5-(1H-imidazo[1,2-a]pyridin-4-ium-8-ylmethyl)-3,3-diphenyl-oxolan-2-one chloride hydrate

Systemtic Name: 5-(1H-imidazo[1,2-a]pyridin-4-ium-8-ylmethyl)-3,3-diphenyl-oxolan-2-one chloride hydrate Openeye Name: 5-(1H-imidazo[1,2-a]pyridin-4-ium-8-ylmethyl)-3,3-diphenyl-tetrahydrofuran-2-one chloride hydrate CAS Name: 5-(1H-imidazo[1,2-a]pyridin-4-ium-8-ylmethyl)-3,3-diphenyl-2-oxolanone chloride hydrate IUPAC Name: 5-(1H-imidazo[1,2-a]pyridin-4-ium-8-ylmethyl)-3,3-diphenyloxolan-2-one chloride hydrate Traditional Name: 5-(1H-imidazo[1,2-a]pyridin-4-ium-8-ylmethyl)-3,3-diphenyl-tetrahydrofuran-2-one chloride hydrate Formula: C24H23ClN2O3 MolecularWeight: 422.90402

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C1(C2=CC=CC=C2)C3=CC=CC=C3)CC4=C5NC=C[N+]5=CC=C4.O.[Cl-]

Isomeric SMILES

C1C(OC(=O)C1(C2=CC=CC=C2)C3=CC=CC=C3)CC4=C5NC=C[N+]5=CC=C4.O.[Cl-]

InChI

InChI=1S/C24H20N2O2.ClH.H2O/c27-23-24(19-9-3-1-4-10-19,20-11-5-2-6-12-20)17-21(28-23)16-18-8-7-14-26-15-13-25-22(18)26;;/h1-15,21H,16-17H2;1H;1H2