[2-[1-(1-adamantyl)ethylamino]-2-oxidanylidene-ethyl] 2-(2,2-dimethylpropanoylamino)propanoate

Systemtic Name: [2-[1-(1-adamantyl)ethylamino]-2-oxidanylidene-ethyl] 2-(2,2-dimethylpropanoylamino)propanoate Openeye Name: [2-[1-(1-adamantyl)ethylamino]-2-oxo-ethyl] 2-(2,2-dimethylpropanoylamino)propanoate CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]propanoic acid [2-[1-(1-adamantyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(1-adamantyl)ethylamino]-2-oxoethyl] 2-(2,2-dimethylpropanoylamino)propanoate Traditional Name: 2-(pivaloylamino)propionic acid [2-[1-(1-adamantyl)ethylamino]-2-keto-ethyl] ester Formula: C22H36N2O4 MolecularWeight: 392.53224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36N2O4/c1-13(23-20(27)21(3,4)5)19(26)28-12-18(25)24-14(2)22-9-15-6-16(10-22)8-17(7-15)11-22/h13-17H,6-12H2,1-5H3,(H,23,27)(H,24,25)