[(2S,3S)-2-phenacyl-6,6-diphenyl-oxan-3-yl] ethanoate

Systemtic Name: [(2S,3S)-2-phenacyl-6,6-diphenyl-oxan-3-yl] ethanoate Openeye Name: [(2S,3S)-2-phenacyl-6,6-diphenyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3S)-2-phenacyl-6,6-diphenyl-3-oxanyl] ester IUPAC Name: [(2S,3S)-2-phenacyl-6,6-diphenyloxan-3-yl] acetate Traditional Name: acetic acid [(2S,3S)-2-phenacyl-6,6-diphenyl-tetrahydropyran-3-yl] ester Formula: C27H26O4 MolecularWeight: 414.49294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC(OC1CC(=O)C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)O[C@H]1CCC(O[C@H]1CC(=O)C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26O4/c1-20(28)30-25-17-18-27(22-13-7-3-8-14-22,23-15-9-4-10-16-23)31-26(25)19-24(29)21-11-5-2-6-12-21/h2-16,25-26H,17-19H2,1H3/t25-,26-/m0/s1