2-(3,3-dimethylbut-1-ynyl)pyrimidine-5-carbaldehyde

Systemtic Name: 2-(3,3-dimethylbut-1-ynyl)pyrimidine-5-carbaldehyde Openeye Name: 2-(3,3-dimethylbut-1-ynyl)pyrimidine-5-carbaldehyde CAS Name: 2-(3,3-dimethylbut-1-ynyl)-5-pyrimidinecarboxaldehyde IUPAC Name: 2-(3,3-dimethylbut-1-ynyl)pyrimidine-5-carbaldehyde Traditional Name: 2-(3,3-dimethylbut-1-ynyl)pyrimidine-5-carbaldehyde Formula: C11H12N2O MolecularWeight: 188.22578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC1=NC=C(C=N1)C=O

Isomeric SMILES

CC(C)(C)C#CC1=NC=C(C=N1)C=O

InChI

InChI=1S/C11H12N2O/c1-11(2,3)5-4-10-12-6-9(8-14)7-13-10/h6-8H,1-3H3