2-[(1E,3E,12E)-tetradeca-1,3,12-trienoxy]phenol hydrate

Systemtic Name: 2-[(1E,3E,12E)-tetradeca-1,3,12-trienoxy]phenol hydrate Openeye Name: 2-[(1E,3E,12E)-tetradeca-1,3,12-trienoxy]phenol hydrate CAS Name: 2-[(1E,3E,12E)-tetradeca-1,3,12-trienoxy]phenol hydrate IUPAC Name: 2-[(1E,3E,12E)-tetradeca-1,3,12-trienoxy]phenol hydrate Traditional Name: 2-[(1E,3E,12E)-tetradeca-1,3,12-trienoxy]phenol hydrate Formula: C20H30O3 MolecularWeight: 318.4504

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCCCCCCC=CC=COC1=CC=CC=C1O.O

Isomeric SMILES

C/C=C/CCCCCCC/C=C/C=C/OC1=CC=CC=C1O.O

InChI

InChI=1S/C20H28O2.H2O/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-22-20-17-14-13-16-19(20)21;/h2-3,11-18,21H,4-10H2,1H3;1H2/b3-2+,12-11+,18-15+;