pentyl 2,2-dimethyl-3-oxidanyl-3-phenyl-propanoate

Systemtic Name: pentyl 2,2-dimethyl-3-oxidanyl-3-phenyl-propanoate Openeye Name: pentyl 3-hydroxy-2,2-dimethyl-3-phenyl-propanoate CAS Name: 3-hydroxy-2,2-dimethyl-3-phenylpropanoic acid pentyl ester IUPAC Name: pentyl 3-hydroxy-2,2-dimethyl-3-phenylpropanoate Traditional Name: 3-hydroxy-2,2-dimethyl-3-phenyl-propionic acid amyl ester Formula: C16H24O3 MolecularWeight: 264.35996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(C)(C)C(C1=CC=CC=C1)O

Isomeric SMILES

CCCCCOC(=O)C(C)(C)C(C1=CC=CC=C1)O

InChI

InChI=1S/C16H24O3/c1-4-5-9-12-19-15(18)16(2,3)14(17)13-10-7-6-8-11-13/h6-8,10-11,14,17H,4-5,9,12H2,1-3H3