[1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-acetamidoadamantane-1-carboxylate

Systemtic Name: [1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-acetamidoadamantane-1-carboxylate Openeye Name: [2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-acetamidoadamantane-1-carboxylate CAS Name: 3-acetamido-1-adamantanecarboxylic acid [1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-acetamidoadamantane-1-carboxylate Traditional Name: 3-acetamidoadamantane-1-carboxylic acid [2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H31N3O5 MolecularWeight: 393.47724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)OC(=O)C12CC3CC(C1)CC(C3)(C2)NC(=O)C

Isomeric SMILES

CC(C)NC(=O)NC(=O)C(C)OC(=O)C12CC3CC(C1)CC(C3)(C2)NC(=O)C

InChI

InChI=1S/C20H31N3O5/c1-11(2)21-18(27)22-16(25)12(3)28-17(26)19-6-14-5-15(7-19)9-20(8-14,10-19)23-13(4)24/h11-12,14-15H,5-10H2,1-4H3,(H,23,24)(H2,21,22,25,27)