methyl 2-[[1-adamantylcarbamoyl(tert-butyl)amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[1-adamantylcarbamoyl(tert-butyl)amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[1-adamantylcarbamoyl(tert-butyl)amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[(1-adamantylamino)-oxomethyl]-tert-butylamino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[1-adamantylcarbamoyl(tert-butyl)amino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[1-adamantylcarbamoyl(tert-butyl)amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=NC(=CO1)C(=O)OC)C(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)(C)N(CC1=NC(=CO1)C(=O)OC)C(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H31N3O4/c1-20(2,3)24(11-17-22-16(12-28-17)18(25)27-4)19(26)23-21-8-13-5-14(9-21)7-15(6-13)10-21/h12-15H,5-11H2,1-4H3,(H,23,26)