(E,4S)-3,7-dimethyl-4-phenylmethoxy-oct-2-ene-1,7-diol

Systemtic Name: (E,4S)-3,7-dimethyl-4-phenylmethoxy-oct-2-ene-1,7-diol Openeye Name: (E,4S)-4-benzyloxy-3,7-dimethyl-oct-2-ene-1,7-diol CAS Name: (E,4S)-3,7-dimethyl-4-phenylmethoxy-2-octene-1,7-diol IUPAC Name: (E,4S)-3,7-dimethyl-4-phenylmethoxyoct-2-ene-1,7-diol Traditional Name: (E,4S)-4-benzoxy-3,7-dimethyl-oct-2-ene-1,7-diol Formula: C17H26O3 MolecularWeight: 278.38654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCO)C(CCC(C)(C)O)OCC1=CC=CC=C1

Isomeric SMILES

C/C(=C\CO)/[C@H](CCC(C)(C)O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H26O3/c1-14(10-12-18)16(9-11-17(2,3)19)20-13-15-7-5-4-6-8-15/h4-8,10,16,18-19H,9,11-13H2,1-3H3/b14-10+/t16-/m0/s1