[2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate

Systemtic Name: [2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate Openeye Name: [2-(1-adamantylcarbamoylamino)-2-oxo-ethyl] 2-(2-chloro-6-fluoro-phenyl)acetate CAS Name: 2-(2-chloro-6-fluorophenyl)acetic acid [2-[[(1-adamantylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylcarbamoylamino)-2-oxoethyl] 2-(2-chloro-6-fluorophenyl)acetate Traditional Name: 2-(2-chloro-6-fluoro-phenyl)acetic acid [2-(1-adamantylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H24ClFN2O4 MolecularWeight: 422.877663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)COC(=O)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)COC(=O)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H24ClFN2O4/c22-16-2-1-3-17(23)15(16)7-19(27)29-11-18(26)24-20(28)25-21-8-12-4-13(9-21)6-14(5-12)10-21/h1-3,12-14H,4-11H2,(H2,24,25,26,28)