[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] (2R)-2-(1-adamantylcarbonylamino)-3-methyl-butanoate

Systemtic Name: [2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] (2R)-2-(1-adamantylcarbonylamino)-3-methyl-butanoate Openeye Name: [2-(2-methoxyethylamino)-2-oxo-ethyl] (2R)-2-(adamantane-1-carbonylamino)-3-methyl-butanoate CAS Name: (2R)-2-[[1-adamantyl(oxo)methyl]amino]-3-methylbutanoic acid [2-(2-methoxyethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyethylamino)-2-oxoethyl] (2R)-2-(adamantane-1-carbonylamino)-3-methylbutanoate Traditional Name: (2R)-2-(adamantane-1-carbonylamino)-3-methyl-butyric acid [2-keto-2-(2-methoxyethylamino)ethyl] ester Formula: C21H34N2O5 MolecularWeight: 394.50506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)NCCOC)NC(=O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C21H34N2O5/c1-13(2)18(19(25)28-12-17(24)22-4-5-27-3)23-20(26)21-9-14-6-15(10-21)8-16(7-14)11-21/h13-16,18H,4-12H2,1-3H3,(H,22,24)(H,23,26)/t14?,15?,16?,18-,21?/m1/s1