2-(2,4-dichlorophenyl)-2-(1,2-dihydroimidazol-3-ylmethyl)-4-phenyl-butanenitrile nitrate

Systemtic Name: 2-(2,4-dichlorophenyl)-2-(1,2-dihydroimidazol-3-ylmethyl)-4-phenyl-butanenitrile nitrate Openeye Name: 2-(2,4-dichlorophenyl)-2-(1,2-dihydroimidazol-3-ylmethyl)-4-phenyl-butanenitrile nitrate CAS Name: 2-(2,4-dichlorophenyl)-2-(1,2-dihydroimidazol-3-ylmethyl)-4-phenylbutanenitrile nitrate IUPAC Name: 2-(2,4-dichlorophenyl)-2-(1,2-dihydroimidazol-3-ylmethyl)-4-phenylbutanenitrile nitrate Traditional Name: 2-(2,4-dichlorophenyl)-2-(4-imidazolin-1-ylmethyl)-4-phenyl-butyronitrile nitrate Formula: C20H19Cl2N4O3- MolecularWeight: 434.29586

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Descriptors Computed from Structure

Canonical SMILES:

C1NC=CN1CC(CCC2=CC=CC=C2)(C#N)C3=C(C=C(C=C3)Cl)Cl.[N+](=O)([O-])[O-]

Isomeric SMILES

C1NC=CN1CC(CCC2=CC=CC=C2)(C#N)C3=C(C=C(C=C3)Cl)Cl.[N+](=O)([O-])[O-]

InChI

InChI=1S/C20H19Cl2N3.NO3/c21-17-6-7-18(19(22)12-17)20(13-23,14-25-11-10-24-15-25)9-8-16-4-2-1-3-5-16;2-1(3)4/h1-7,10-12,24H,8-9,14-15H2;/q;-1