(4S,5R)-2,2,5-trimethyl-4-[(2S)-1-phenylmethoxypropan-2-yl]-1,3-dioxepane

Systemtic Name: (4S,5R)-2,2,5-trimethyl-4-[(2S)-1-phenylmethoxypropan-2-yl]-1,3-dioxepane Openeye Name: (4S,5R)-4-[(1S)-2-benzyloxy-1-methyl-ethyl]-2,2,5-trimethyl-1,3-dioxepane CAS Name: (4S,5R)-2,2,5-trimethyl-4-[(2S)-1-phenylmethoxypropan-2-yl]-1,3-dioxepane IUPAC Name: (4S,5R)-2,2,5-trimethyl-4-[(2S)-1-phenylmethoxypropan-2-yl]-1,3-dioxepane Traditional Name: (4S,5R)-4-[(1S)-2-benzoxy-1-methyl-ethyl]-2,2,5-trimethyl-1,3-dioxepane Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCOC(OC1C(C)COCC2=CC=CC=C2)(C)C

Isomeric SMILES

C[C@@H]1CCOC(O[C@@H]1[C@@H](C)COCC2=CC=CC=C2)(C)C

InChI

InChI=1S/C18H28O3/c1-14-10-11-20-18(3,4)21-17(14)15(2)12-19-13-16-8-6-5-7-9-16/h5-9,14-15,17H,10-13H2,1-4H3/t14-,15+,17+/m1/s1