5-methyl-4-pyridin-2-yl-hexan-3-one

Systemtic Name: 5-methyl-4-pyridin-2-yl-hexan-3-one Openeye Name: 5-methyl-4-(2-pyridyl)hexan-3-one CAS Name: 5-methyl-4-(2-pyridinyl)-3-hexanone IUPAC Name: 5-methyl-4-pyridin-2-ylhexan-3-one Traditional Name: 5-methyl-4-(2-pyridyl)hexan-3-one Formula: C12H17NO MolecularWeight: 191.26948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO/c1-4-11(14)12(9(2)3)10-7-5-6-8-13-10/h5-9,12H,4H2,1-3H3