phenyl 2,2-dimethyl-3-oxidanyl-heptanoate

Systemtic Name: phenyl 2,2-dimethyl-3-oxidanyl-heptanoate Openeye Name: phenyl 3-hydroxy-2,2-dimethyl-heptanoate CAS Name: 3-hydroxy-2,2-dimethylheptanoic acid phenyl ester IUPAC Name: phenyl 3-hydroxy-2,2-dimethylheptanoate Traditional Name: 3-hydroxy-2,2-dimethyl-enanthic acid phenyl ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)(C)C(=O)OC1=CC=CC=C1)O

Isomeric SMILES

CCCCC(C(C)(C)C(=O)OC1=CC=CC=C1)O

InChI

InChI=1S/C15H22O3/c1-4-5-11-13(16)15(2,3)14(17)18-12-9-7-6-8-10-12/h6-10,13,16H,4-5,11H2,1-3H3