ethyl 12-(1-adamantylcarbamoylamino)-2-fluoranyl-dodecanoate

Systemtic Name: ethyl 12-(1-adamantylcarbamoylamino)-2-fluoranyl-dodecanoate Openeye Name: ethyl 12-(1-adamantylcarbamoylamino)-2-fluoro-dodecanoate CAS Name: 12-[[(1-adamantylamino)-oxomethyl]amino]-2-fluorododecanoic acid ethyl ester IUPAC Name: ethyl 12-(1-adamantylcarbamoylamino)-2-fluorododecanoate Traditional Name: 12-(1-adamantylcarbamoylamino)-2-fluoro-lauric acid ethyl ester Formula: C25H43FN2O3 MolecularWeight: 438.618923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCCCCCCNC(=O)NC12CC3CC(C1)CC(C3)C2)F

Isomeric SMILES

CCOC(=O)C(CCCCCCCCCCNC(=O)NC12CC3CC(C1)CC(C3)C2)F

InChI

InChI=1S/C25H43FN2O3/c1-2-31-23(29)22(26)11-9-7-5-3-4-6-8-10-12-27-24(30)28-25-16-19-13-20(17-25)15-21(14-19)18-25/h19-22H,2-18H2,1H3,(H2,27,28,30)