ethyl 6-acetyloxyhexanoate; 2-methyl-3-phenyl-butan-2-ol

Systemtic Name: ethyl 6-acetyloxyhexanoate; 2-methyl-3-phenyl-butan-2-ol Openeye Name: ethyl 6-acetoxyhexanoate; 2-methyl-3-phenyl-butan-2-ol CAS Name: 6-acetyloxyhexanoic acid ethyl ester; 2-methyl-3-phenyl-2-butanol IUPAC Name: ethyl 6-acetyloxyhexanoate; 2-methyl-3-phenylbutan-2-ol Traditional Name: 6-acetoxyhexanoic acid ethyl ester; 2-methyl-3-phenyl-butan-2-ol Formula: C21H34O5 MolecularWeight: 366.49166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O.C10H18O4/c1-9(11(2,3)12)10-7-5-4-6-8-10;1-3-13-10(12)7-5-4-6-8-14-9(2)11/h4-9,12H,1-3H3;3-8H2,1-2H3