2-[(4Z,7Z,12E)-11-methoxypentadeca-4,7,12-trien-2-yl]-3-oxidanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-[(4Z,7Z,12E)-11-methoxypentadeca-4,7,12-trien-2-yl]-3-oxidanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-hydroxy-3-[(3Z,6Z,11E)-10-methoxy-1-methyl-tetradeca-3,6,11-trienyl]-1,4-benzoquinone CAS Name: 2-hydroxy-3-[(4Z,7Z,12E)-11-methoxypentadeca-4,7,12-trien-2-yl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-hydroxy-3-[(4Z,7Z,12E)-11-methoxypentadeca-4,7,12-trien-2-yl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-hydroxy-3-[(3Z,6Z,11E)-10-methoxy-1-methyl-tetradeca-3,6,11-trienyl]-p-benzoquinone Formula: C22H30O4 MolecularWeight: 358.4712

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(CCC=CCC=CCC(C)C1=C(C(=O)C=CC1=O)O)OC

Isomeric SMILES

CC/C=C/C(CC/C=C\C/C=C\CC(C)C1=C(C(=O)C=CC1=O)O)OC

InChI

InChI=1S/C22H30O4/c1-4-5-13-18(26-3)14-11-9-7-6-8-10-12-17(2)21-19(23)15-16-20(24)22(21)25/h5,7-10,13,15-18,25H,4,6,11-12,14H2,1-3H3/b9-7-,10-8-,13-5+