(5E,9Z)-4,10-dimethyl-3-pyridin-4-yloxycarbonyl-dodeca-5,9-dienoic acid

Systemtic Name: (5E,9Z)-4,10-dimethyl-3-pyridin-4-yloxycarbonyl-dodeca-5,9-dienoic acid Openeye Name: (5E,9Z)-4,10-dimethyl-3-(4-pyridyloxycarbonyl)dodeca-5,9-dienoic acid CAS Name: (5E,9Z)-4,10-dimethyl-3-[oxo(pyridin-4-yloxy)methyl]dodeca-5,9-dienoic acid IUPAC Name: (5E,9Z)-4,10-dimethyl-3-pyridin-4-yloxycarbonyldodeca-5,9-dienoic acid Traditional Name: (5E,9Z)-4,10-dimethyl-3-(4-pyridyloxycarbonyl)dodeca-5,9-dienoic acid Formula: C20H27NO4 MolecularWeight: 345.43268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=CCCC=CC(C)C(CC(=O)O)C(=O)OC1=CC=NC=C1)C

Isomeric SMILES

CC/C(=C\CC/C=C/C(C)C(CC(=O)O)C(=O)OC1=CC=NC=C1)/C

InChI

InChI=1S/C20H27NO4/c1-4-15(2)8-6-5-7-9-16(3)18(14-19(22)23)20(24)25-17-10-12-21-13-11-17/h7-13,16,18H,4-6,14H2,1-3H3,(H,22,23)/b9-7+,15-8-