5-[3-(1-hydroxyethyl)oxiran-2-yl]-6-methyl-heptan-2-one

Systemtic Name: 5-[3-(1-hydroxyethyl)oxiran-2-yl]-6-methyl-heptan-2-one Openeye Name: 5-[3-(1-hydroxyethyl)oxiran-2-yl]-6-methyl-heptan-2-one CAS Name: 5-[3-(1-hydroxyethyl)-2-oxiranyl]-6-methyl-2-heptanone IUPAC Name: 5-[3-(1-hydroxyethyl)oxiran-2-yl]-6-methylheptan-2-one Traditional Name: 5-[3-(1-hydroxyethyl)oxiran-2-yl]-6-methyl-heptan-2-one Formula: C12H22O3 MolecularWeight: 214.30128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC(=O)C)C1C(O1)C(C)O

Isomeric SMILES

CC(C)C(CCC(=O)C)C1C(O1)C(C)O

InChI

InChI=1S/C12H22O3/c1-7(2)10(6-5-8(3)13)12-11(15-12)9(4)14/h7,9-12,14H,5-6H2,1-4H3