(2R,5R,6R)-2-tert-butyl-6-methyl-5-[(1S)-1-phenylheptyl]-1,3-dioxan-4-one

Systemtic Name: (2R,5R,6R)-2-tert-butyl-6-methyl-5-[(1S)-1-phenylheptyl]-1,3-dioxan-4-one Openeye Name: (2R,5R,6R)-2-tert-butyl-6-methyl-5-[(1S)-1-phenylheptyl]-1,3-dioxan-4-one CAS Name: (2R,5R,6R)-2-tert-butyl-6-methyl-5-[(1S)-1-phenylheptyl]-1,3-dioxan-4-one IUPAC Name: (2R,5R,6R)-2-tert-butyl-6-methyl-5-[(1S)-1-phenylheptyl]-1,3-dioxan-4-one Traditional Name: (2R,5R,6R)-2-tert-butyl-6-methyl-5-[(1S)-1-phenylheptyl]-1,3-dioxan-4-one Formula: C22H34O3 MolecularWeight: 346.50356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1C(OC(OC1=O)C(C)(C)C)C)C2=CC=CC=C2

Isomeric SMILES

CCCCCC[C@@H]([C@@H]1[C@H](O[C@H](OC1=O)C(C)(C)C)C)C2=CC=CC=C2

InChI

InChI=1S/C22H34O3/c1-6-7-8-12-15-18(17-13-10-9-11-14-17)19-16(2)24-21(22(3,4)5)25-20(19)23/h9-11,13-14,16,18-19,21H,6-8,12,15H2,1-5H3/t16-,18-,19+,21-/m1/s1