2,3,5-trimethyl-6-[(5E,10E)-12-oxidanyldodeca-5,10-dienyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,3,5-trimethyl-6-[(5E,10E)-12-oxidanyldodeca-5,10-dienyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-[(5E,10E)-12-hydroxydodeca-5,10-dienyl]-3,5,6-trimethyl-1,4-benzoquinone CAS Name: 2-[(5E,10E)-12-hydroxydodeca-5,10-dienyl]-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-[(5E,10E)-12-hydroxydodeca-5,10-dienyl]-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[(5E,10E)-12-hydroxydodeca-5,10-dienyl]-3,5,6-trimethyl-p-benzoquinone Formula: C21H30O3 MolecularWeight: 330.4611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C)CCCCC=CCCCC=CCO)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C)CCCC/C=C/CCC/C=C/CO)C

InChI

InChI=1S/C21H30O3/c1-16-17(2)21(24)19(18(3)20(16)23)14-12-10-8-6-4-5-7-9-11-13-15-22/h4,6,11,13,22H,5,7-10,12,14-15H2,1-3H3/b6-4+,13-11+