2-[(1E,3E,6E)-pentadeca-1,3,6-trienoxy]benzoic acid

Systemtic Name: 2-[(1E,3E,6E)-pentadeca-1,3,6-trienoxy]benzoic acid Openeye Name: 2-[(1E,3E,6E)-pentadeca-1,3,6-trienoxy]benzoic acid CAS Name: 2-[(1E,3E,6E)-pentadeca-1,3,6-trienoxy]benzoic acid IUPAC Name: 2-[(1E,3E,6E)-pentadeca-1,3,6-trienoxy]benzoic acid Traditional Name: 2-[(1E,3E,6E)-pentadeca-1,3,6-trienoxy]benzoic acid Formula: C22H30O3 MolecularWeight: 342.4718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCC=CC=COC1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/C/C=C/C=C/OC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C22H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-25-21-18-15-14-17-20(21)22(23)24/h9-10,12-19H,2-8,11H2,1H3,(H,23,24)/b10-9+,13-12+,19-16+