ethyl 8-(1-adamantylcarbamoylamino)-2-fluoranyl-octanoate

Systemtic Name: ethyl 8-(1-adamantylcarbamoylamino)-2-fluoranyl-octanoate Openeye Name: ethyl 8-(1-adamantylcarbamoylamino)-2-fluoro-octanoate CAS Name: 8-[[(1-adamantylamino)-oxomethyl]amino]-2-fluorooctanoic acid ethyl ester IUPAC Name: ethyl 8-(1-adamantylcarbamoylamino)-2-fluorooctanoate Traditional Name: 8-(1-adamantylcarbamoylamino)-2-fluoro-caprylic acid ethyl ester Formula: C21H35FN2O3 MolecularWeight: 382.512603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35FN2O3/c1-2-27-19(25)18(22)7-5-3-4-6-8-23-20(26)24-21-12-15-9-16(13-21)11-17(10-15)14-21/h15-18H,2-14H2,1H3,(H2,23,24,26)