5-butanoyl-2-butyl-1H-imidazole-4-carbonitrile

Systemtic Name: 5-butanoyl-2-butyl-1H-imidazole-4-carbonitrile Openeye Name: 5-butanoyl-2-butyl-1H-imidazole-4-carbonitrile CAS Name: 2-butyl-5-(1-oxobutyl)-1H-imidazole-4-carbonitrile IUPAC Name: 5-butanoyl-2-butyl-1H-imidazole-4-carbonitrile Traditional Name: 2-butyl-5-butyryl-1H-imidazole-4-carbonitrile Formula: C12H17N3O MolecularWeight: 219.28288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1)C(=O)CCC)C#N

Isomeric SMILES

CCCCC1=NC(=C(N1)C(=O)CCC)C#N

InChI

InChI=1S/C12H17N3O/c1-3-5-7-11-14-9(8-13)12(15-11)10(16)6-4-2/h3-7H2,1-2H3,(H,14,15)