[1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2,4,5-trimethylfuran-3-carboxylate

Systemtic Name: [1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2,4,5-trimethylfuran-3-carboxylate Openeye Name: [2-(1-adamantylcarbamoylamino)-1-methyl-2-oxo-ethyl] 2,4,5-trimethylfuran-3-carboxylate CAS Name: 2,4,5-trimethyl-3-furancarboxylic acid [1-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(1-adamantylcarbamoylamino)-1-oxopropan-2-yl] 2,4,5-trimethylfuran-3-carboxylate Traditional Name: 2,4,5-trimethylfuran-3-carboxylic acid [2-(1-adamantylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C22H30N2O5 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C(=O)OC(C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)C)C

Isomeric SMILES

CC1=C(OC(=C1C(=O)OC(C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)C)C

InChI

InChI=1S/C22H30N2O5/c1-11-12(2)28-13(3)18(11)20(26)29-14(4)19(25)23-21(27)24-22-8-15-5-16(9-22)7-17(6-15)10-22/h14-17H,5-10H2,1-4H3,(H2,23,24,25,27)