1-[[2-(2,4-dichlorophenyl)-4-(phenylsulfanylmethyl)-1,3-dioxolan-2-yl]methyl]imidazole nitrate

Systemtic Name: 1-[[2-(2,4-dichlorophenyl)-4-(phenylsulfanylmethyl)-1,3-dioxolan-2-yl]methyl]imidazole nitrate Openeye Name: 1-[[2-(2,4-dichlorophenyl)-4-(phenylsulfanylmethyl)-1,3-dioxolan-2-yl]methyl]imidazole nitrate CAS Name: 1-[[2-(2,4-dichlorophenyl)-4-[(phenylthio)methyl]-1,3-dioxolan-2-yl]methyl]imidazole nitrate IUPAC Name: 1-[[2-(2,4-dichlorophenyl)-4-(phenylsulfanylmethyl)-1,3-dioxolan-2-yl]methyl]imidazole nitrate Traditional Name: 1-[[2-(2,4-dichlorophenyl)-4-[(phenylthio)methyl]-1,3-dioxolan-2-yl]methyl]imidazole nitrate Formula: C20H18Cl2N3O5S- MolecularWeight: 483.34502

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(O1)(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)CSC4=CC=CC=C4.[N+](=O)([O-])[O-]

Isomeric SMILES

C1C(OC(O1)(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)CSC4=CC=CC=C4.[N+](=O)([O-])[O-]

InChI

InChI=1S/C20H18Cl2N2O2S.NO3/c21-15-6-7-18(19(22)10-15)20(13-24-9-8-23-14-24)25-11-16(26-20)12-27-17-4-2-1-3-5-17;2-1(3)4/h1-10,14,16H,11-13H2;/q;-1