4-methyloxan-2-one; oxan-2-one; oxepan-2-one

Systemtic Name: 4-methyloxan-2-one; oxan-2-one; oxepan-2-one Openeye Name: 4-methyltetrahydropyran-2-one; oxepan-2-one; tetrahydropyran-2-one CAS Name: 4-methyl-2-oxanone; 2-oxanone; 2-oxepanone IUPAC Name: 4-methyloxan-2-one; oxan-2-one; oxepan-2-one Traditional Name: 4-methyltetrahydropyran-2-one; oxepan-2-one; tetrahydropyran-2-one Formula: C17H28O6 MolecularWeight: 328.40062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCOC(=O)C1.C1CCC(=O)OCC1.C1CCOC(=O)C1

Isomeric SMILES

CC1CCOC(=O)C1.C1CCC(=O)OCC1.C1CCOC(=O)C1

InChI

InChI=1S/2C6H10O2.C5H8O2/c1-5-2-3-8-6(7)4-5;7-6-4-2-1-3-5-8-6;6-5-3-1-2-4-7-5/h5H,2-4H2,1H3;1-5H2;1-4H2