(phenylmethyl) 2,2-dimethyl-7-oxidanyl-3-oxidanylidene-heptanoate

Systemtic Name: (phenylmethyl) 2,2-dimethyl-7-oxidanyl-3-oxidanylidene-heptanoate Openeye Name: benzyl 7-hydroxy-2,2-dimethyl-3-oxo-heptanoate CAS Name: 7-hydroxy-2,2-dimethyl-3-oxoheptanoic acid (phenylmethyl) ester IUPAC Name: benzyl 7-hydroxy-2,2-dimethyl-3-oxoheptanoate Traditional Name: 7-hydroxy-3-keto-2,2-dimethyl-enanthic acid benzyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)CCCCO)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C(=O)CCCCO)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H22O4/c1-16(2,14(18)10-6-7-11-17)15(19)20-12-13-8-4-3-5-9-13/h3-5,8-9,17H,6-7,10-12H2,1-2H3