3-(2,4-dichlorophenyl)-2-methyl-3-oxidanyl-4-(1,2,4-triazol-1-yl)butanenitrile

Systemtic Name: 3-(2,4-dichlorophenyl)-2-methyl-3-oxidanyl-4-(1,2,4-triazol-1-yl)butanenitrile Openeye Name: 3-(2,4-dichlorophenyl)-3-hydroxy-2-methyl-4-(1,2,4-triazol-1-yl)butanenitrile CAS Name: 3-(2,4-dichlorophenyl)-3-hydroxy-2-methyl-4-(1,2,4-triazol-1-yl)butanenitrile IUPAC Name: 3-(2,4-dichlorophenyl)-3-hydroxy-2-methyl-4-(1,2,4-triazol-1-yl)butanenitrile Traditional Name: 3-(2,4-dichlorophenyl)-3-hydroxy-2-methyl-4-(1,2,4-triazol-1-yl)butyronitrile Formula: C13H12Cl2N4O MolecularWeight: 311.16658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C(CN1C=NC=N1)(C2=C(C=C(C=C2)Cl)Cl)O

Isomeric SMILES

CC(C#N)C(CN1C=NC=N1)(C2=C(C=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C13H12Cl2N4O/c1-9(5-16)13(20,6-19-8-17-7-18-19)11-3-2-10(14)4-12(11)15/h2-4,7-9,20H,6H2,1H3