2,2-bis(4-chlorophenyl)-3-(1,2,4-triazol-4-yl)propanenitrile

Systemtic Name: 2,2-bis(4-chlorophenyl)-3-(1,2,4-triazol-4-yl)propanenitrile Openeye Name: 2,2-bis(4-chlorophenyl)-3-(1,2,4-triazol-4-yl)propanenitrile CAS Name: 2,2-bis(4-chlorophenyl)-3-(1,2,4-triazol-4-yl)propanenitrile IUPAC Name: 2,2-bis(4-chlorophenyl)-3-(1,2,4-triazol-4-yl)propanenitrile Traditional Name: 2,2-bis(4-chlorophenyl)-3-(1,2,4-triazol-4-yl)propionitrile Formula: C17H12Cl2N4 MolecularWeight: 343.20998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CN2C=NN=C2)(C#N)C3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C(CN2C=NN=C2)(C#N)C3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H12Cl2N4/c18-15-5-1-13(2-6-15)17(9-20,10-23-11-21-22-12-23)14-3-7-16(19)8-4-14/h1-8,11-12H,10H2