1-[[2-(4-phenylphenyl)-1,3-dioxan-2-yl]methyl]imidazole nitrate

Systemtic Name: 1-[[2-(4-phenylphenyl)-1,3-dioxan-2-yl]methyl]imidazole nitrate Openeye Name: 1-[[2-(4-phenylphenyl)-1,3-dioxan-2-yl]methyl]imidazole nitrate CAS Name: 1-[[2-(4-phenylphenyl)-1,3-dioxan-2-yl]methyl]imidazole nitrate IUPAC Name: 1-[[2-(4-phenylphenyl)-1,3-dioxan-2-yl]methyl]imidazole nitrate Traditional Name: 1-[[2-(4-phenylphenyl)-1,3-dioxan-2-yl]methyl]imidazole nitrate Formula: C20H20N3O5- MolecularWeight: 382.3899

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(OC1)(CN2C=CN=C2)C3=CC=C(C=C3)C4=CC=CC=C4.[N+](=O)([O-])[O-]

Isomeric SMILES

C1COC(OC1)(CN2C=CN=C2)C3=CC=C(C=C3)C4=CC=CC=C4.[N+](=O)([O-])[O-]

InChI

InChI=1S/C20H20N2O2.NO3/c1-2-5-17(6-3-1)18-7-9-19(10-8-18)20(23-13-4-14-24-20)15-22-12-11-21-16-22;2-1(3)4/h1-3,5-12,16H,4,13-15H2;/q;-1