2-(4-tert-butylphenyl)-3-oxidanylidene-3-(2,4,5-trimethylpyrazol-3-yl)propanenitrile

Systemtic Name: 2-(4-tert-butylphenyl)-3-oxidanylidene-3-(2,4,5-trimethylpyrazol-3-yl)propanenitrile Openeye Name: 2-(4-tert-butylphenyl)-3-oxo-3-(2,4,5-trimethylpyrazol-3-yl)propanenitrile CAS Name: 2-(4-tert-butylphenyl)-3-oxo-3-(2,4,5-trimethyl-3-pyrazolyl)propanenitrile IUPAC Name: 2-(4-tert-butylphenyl)-3-oxo-3-(2,4,5-trimethylpyrazol-3-yl)propanenitrile Traditional Name: 2-(4-tert-butylphenyl)-3-keto-3-(2,4,5-trimethylpyrazol-3-yl)propionitrile Formula: C19H23N3O MolecularWeight: 309.40542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C)C)C(=O)C(C#N)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=C(N(N=C1C)C)C(=O)C(C#N)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C19H23N3O/c1-12-13(2)21-22(6)17(12)18(23)16(11-20)14-7-9-15(10-8-14)19(3,4)5/h7-10,16H,1-6H3