(4S)-4-[(2S,4R,6S)-6-hexyl-2-propan-2-yl-1,3-dioxan-4-yl]-4-phenyl-butan-2-one

Systemtic Name: (4S)-4-[(2S,4R,6S)-6-hexyl-2-propan-2-yl-1,3-dioxan-4-yl]-4-phenyl-butan-2-one Openeye Name: (4S)-4-[(2S,4R,6S)-6-hexyl-2-isopropyl-1,3-dioxan-4-yl]-4-phenyl-butan-2-one CAS Name: (4S)-4-[(2S,4R,6S)-6-hexyl-2-propan-2-yl-1,3-dioxan-4-yl]-4-phenyl-2-butanone IUPAC Name: (4S)-4-[(2S,4R,6S)-6-hexyl-2-propan-2-yl-1,3-dioxan-4-yl]-4-phenylbutan-2-one Traditional Name: (4S)-4-[(2S,4R,6S)-6-hexyl-2-isopropyl-1,3-dioxan-4-yl]-4-phenyl-butan-2-one Formula: C23H36O3 MolecularWeight: 360.53014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(OC(O1)C(C)C)C(CC(=O)C)C2=CC=CC=C2

Isomeric SMILES

CCCCCC[C@H]1C[C@@H](O[C@H](O1)C(C)C)[C@@H](CC(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C23H36O3/c1-5-6-7-11-14-20-16-22(26-23(25-20)17(2)3)21(15-18(4)24)19-12-9-8-10-13-19/h8-10,12-13,17,20-23H,5-7,11,14-16H2,1-4H3/t20-,21-,22+,23-/m0/s1