1-[3,6-dimethyl-5-(3-methylbutyl)pyrazin-2-yl]propan-1-one

Systemtic Name: 1-[3,6-dimethyl-5-(3-methylbutyl)pyrazin-2-yl]propan-1-one Openeye Name: 1-(5-isopentyl-3,6-dimethyl-pyrazin-2-yl)propan-1-one CAS Name: 1-[3,6-dimethyl-5-(3-methylbutyl)-2-pyrazinyl]-1-propanone IUPAC Name: 1-[3,6-dimethyl-5-(3-methylbutyl)pyrazin-2-yl]propan-1-one Traditional Name: 1-(5-isoamyl-3,6-dimethyl-pyrazin-2-yl)propan-1-one Formula: C14H22N2O MolecularWeight: 234.33728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(N=C(C(=N1)C)CCC(C)C)C

Isomeric SMILES

CCC(=O)C1=C(N=C(C(=N1)C)CCC(C)C)C

InChI

InChI=1S/C14H22N2O/c1-6-13(17)14-11(5)15-12(10(4)16-14)8-7-9(2)3/h9H,6-8H2,1-5H3