[2-[(2R,6S)-6-pentyloxan-2-yl]-1-[(3S)-1-phenylhex-5-en-3-yl]oxy-ethyl] ethanoate

Systemtic Name: [2-[(2R,6S)-6-pentyloxan-2-yl]-1-[(3S)-1-phenylhex-5-en-3-yl]oxy-ethyl] ethanoate Openeye Name: [2-[(2R,6S)-6-pentyltetrahydropyran-2-yl]-1-[(1S)-1-phenethylbut-3-enoxy]ethyl] acetate CAS Name: acetic acid [2-[(2R,6S)-6-pentyl-2-oxanyl]-1-[(3S)-1-phenylhex-5-en-3-yl]oxyethyl] ester IUPAC Name: [2-[(2R,6S)-6-pentyloxan-2-yl]-1-[(3S)-1-phenylhex-5-en-3-yl]oxyethyl] acetate Traditional Name: acetic acid [2-[(2R,6S)-6-amyltetrahydropyran-2-yl]-1-[(1S)-1-phenethylbut-3-enoxy]ethyl] ester Formula: C26H40O4 MolecularWeight: 416.5934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCCC(O1)CC(OC(CCC2=CC=CC=C2)CC=C)OC(=O)C

Isomeric SMILES

CCCCC[C@H]1CCC[C@@H](O1)CC(O[C@@H](CCC2=CC=CC=C2)CC=C)OC(=O)C

InChI

InChI=1S/C26H40O4/c1-4-6-8-15-24-16-11-17-25(29-24)20-26(28-21(3)27)30-23(12-5-2)19-18-22-13-9-7-10-14-22/h5,7,9-10,13-14,23-26H,2,4,6,8,11-12,15-20H2,1,3H3/t23-,24+,25-,26?/m1/s1