[(2S,3R)-3,7-dimethyl-3-oxidanyl-1-phenylmethoxy-oct-6-en-2-yl] ethanoate

Systemtic Name: [(2S,3R)-3,7-dimethyl-3-oxidanyl-1-phenylmethoxy-oct-6-en-2-yl] ethanoate Openeye Name: [(1S,2R)-1-(benzyloxymethyl)-2-hydroxy-2,6-dimethyl-hept-5-enyl] acetate CAS Name: acetic acid [(2S,3R)-3-hydroxy-3,7-dimethyl-1-phenylmethoxyoct-6-en-2-yl] ester IUPAC Name: [(2S,3R)-3-hydroxy-3,7-dimethyl-1-phenylmethoxyoct-6-en-2-yl] acetate Traditional Name: acetic acid [(1S,2R)-1-(benzoxymethyl)-2-hydroxy-2,6-dimethyl-hept-5-enyl] ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(C)(C(COCC1=CC=CC=C1)OC(=O)C)O)C

Isomeric SMILES

CC(=CCC[C@](C)([C@H](COCC1=CC=CC=C1)OC(=O)C)O)C

InChI

InChI=1S/C19H28O4/c1-15(2)9-8-12-19(4,21)18(23-16(3)20)14-22-13-17-10-6-5-7-11-17/h5-7,9-11,18,21H,8,12-14H2,1-4H3/t18-,19+/m0/s1