2-(4-chlorophenyl)-4-methyl-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile

Systemtic Name: 2-(4-chlorophenyl)-4-methyl-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile Openeye Name: 2-(4-chlorophenyl)-4-methyl-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile CAS Name: 2-(4-chlorophenyl)-4-methyl-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile IUPAC Name: 2-(4-chlorophenyl)-4-methyl-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile Traditional Name: 2-(4-chlorophenyl)-4-methyl-2-(1,2,4-triazol-1-ylmethyl)valeronitrile Formula: C15H17ClN4 MolecularWeight: 288.77528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN4/c1-12(2)7-15(8-17,9-20-11-18-10-19-20)13-3-5-14(16)6-4-13/h3-6,10-12H,7,9H2,1-2H3