(2,2-dimethyl-3-oxidanyl-propyl) 2,2-dimethyl-3-oxidanyl-propanoate; oxepan-2-one

Systemtic Name: (2,2-dimethyl-3-oxidanyl-propyl) 2,2-dimethyl-3-oxidanyl-propanoate; oxepan-2-one Openeye Name: (3-hydroxy-2,2-dimethyl-propyl) 3-hydroxy-2,2-dimethyl-propanoate; oxepan-2-one CAS Name: 3-hydroxy-2,2-dimethylpropanoic acid (3-hydroxy-2,2-dimethylpropyl) ester; 2-oxepanone IUPAC Name: (3-hydroxy-2,2-dimethylpropyl) 3-hydroxy-2,2-dimethylpropanoate; oxepan-2-one Traditional Name: 3-hydroxy-2,2-dimethyl-propionic acid (3-hydroxy-2,2-dimethyl-propyl) ester; oxepan-2-one Formula: C16H30O6 MolecularWeight: 318.4058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)COC(=O)C(C)(C)CO.C1CCC(=O)OCC1

Isomeric SMILES

CC(C)(CO)COC(=O)C(C)(C)CO.C1CCC(=O)OCC1

InChI

InChI=1S/C10H20O4.C6H10O2/c1-9(2,5-11)7-14-8(13)10(3,4)6-12;7-6-4-2-1-3-5-8-6/h11-12H,5-7H2,1-4H3;1-5H2